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Fosthiazate

PubChem CID: 91758

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Compound Synonyms Fosthiazate, 98886-44-3, Nemathorin, Fosthiazate [ISO:BSI], 3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-1,3-thiazolidin-2-one, IKI 1145, (RS)-S-sec-butyl-O-ethyl-2-oxo-1,3-thiazolidin-3-ylphosphonothioate, ASC-66824, DTXSID0034930, CHEBI:38692, HSDB 7961, O-Ethyl S-(1-methylpropyl) (2-oxo-3-thiazolidinyl)phosphonothioate, 96QJ4O095U, FOSTHIAZATE [MI], FOSTHIAZATE [ISO], FOSTHIAZATE (ISO:BSI), DTXCID8014930, O-Ethyl S-(1-methylpropyl) 2-oxo-3-thiazolidinylphosphonothioate, S-sec-butyl O-ethyl (2-oxo-1,3-thiazolidin-3-yl)phosphonothioate, S-sec-Butyl O-ethyl (2-oxo-1,3-thiazolidine-3-yl)phosphonothioate, Phosphonothioic acid, (2-oxo-3-thiazolidinyl)-, O-ethyl S-(1-methylpropyl) ester, Fosthiazate 10 microg/mL in Acetonitrile, ethyl (butan-2-ylsulfanyl)(2-oxo-1,3-thiazolidin-3-yl)phosphinate, O-ethyl S-(butan-2-yl) (2-oxo-1,3-thiazolidin-3-yl)phosphonothioate, (RS)-(S-(RS)-SEC-BUTYL O-ETHYL 2-OXO-1,3-THIAZOLIDIN-3-YLPHOSPHONOTHIOATE), Fosthiazic acid, UNII-96QJ4O095U, 3-(butan-2-ylsulfanyl(ethoxy)phosphoryl)-1,3-thiazolidin-2-one, FOSTHIAZATE-1, FOSTHIAZATE-2, SCHEMBL73578, CHEMBL1905657, DUFVKSUJRWYZQP-UHFFFAOYSA-, S-sec-Butyl O-ethyl 2-oxo-3-thiazolidinylphosphonothioate, S-sec-butyl-O-ethyl(2-oxo-3-thiazolidinyl)phosphonothioate, MSK20084, Tox21_301059, AKOS015897274, FF32412, HY-W020785, Phosphonothioic acid, P-(2-oxo-3-thiazolidinyl)-, O-ethyl S-(1-methylpropyl) ester, NCGC00168316-01, NCGC00168316-02, NCGC00254961-01, 1ST20084, DA-53392, CAS-98886-44-3, CS-0031917, NS00000489, C18402, Fosthiazate, PESTANAL(R), analytical standard, Q1266349, S-sec-butyl O-ethyl 2-oxothiazolidin-3-ylphosphonothioate, 3-(butan-2-ylsulfanyl-ethoxyphosphoryl)-1,3-thiazolidin-2-one, 3-[ethoxy-[(1S)-1-methylpropyl]sulfanyl-phosphoryl]thiazolidin-2-one, (2-Oxo-3-thiazolidinyl)phosphonothioic acid O-ethyl S-(1-methylpropyl) ester, (RS)-S-SEC-BUTYL-O-ETHYL-2-OXO-1,3-THIAZOLODIN-3-YLPHOSPHONOTHIOATE, 619-377-3, InChI=1/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3
Topological Polar Surface Area 97.2
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 16.0
Isotope Atom Count 0.0
Molecular Complexity 300.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P10275, P04150, Q9R1A7, Q7YWJ9
Iupac Name 3-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-1,3-thiazolidin-2-one
Prediction Hob 1.0
Xlogp 2.0
Molecular Formula C9H18NO3PS2
Prediction Swissadme 1.0
Inchi Key DUFVKSUJRWYZQP-UHFFFAOYSA-N
Fcsp3 0.8888888888888888
Logs -1.451
Rotatable Bond Count 6.0
Logd 1.354
Compound Name Fosthiazate
Prediction Hob Swissadme 1.0
Exact Mass 283.047
Formal Charge 0.0
Monoisotopic Mass 283.047
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 283.4
Covalent Unit Count 1.0
Total Atom Stereocenter Count 2.0
Total Bond Stereocenter Count 0.0
Esol -2.259201
Inchi InChI=1S/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3
Smiles CCC(C)SP(=O)(N1CCSC1=O)OCC
Nring 1.0
Defined Bond Stereocenter Count 0.0

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