S-(4-methoxypyrazolidin-1-yl) N-(4-chloranyl-2-fluoranyl-5-sulfanyl-phenyl)carbamothioate

Systemtic Name: S-(4-methoxypyrazolidin-1-yl) N-(4-chloranyl-2-fluoranyl-5-sulfanyl-phenyl)carbamothioate Openeye Name: S-(4-methoxypyrazolidin-1-yl) N-(4-chloro-2-fluoro-5-sulfanyl-phenyl)carbamothioate CAS Name: N-(4-chloro-2-fluoro-5-mercaptophenyl)carbamothioic acid S-[(4-methoxy-1-pyrazolidinyl)] ester IUPAC Name: S-(4-methoxypyrazolidin-1-yl) N-(4-chloro-2-fluoro-5-sulfanylphenyl)carbamothioate Traditional Name: N-(4-chloro-2-fluoro-5-mercapto-phenyl)thiocarbamic acid S-(4-methoxypyrazolidin-1-yl) ester Formula: C11H13ClFN3O2S2 MolecularWeight: 337.821223

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Descriptors Computed from Structure

Canonical SMILES:

COC1CNN(C1)SC(=O)NC2=CC(=C(C=C2F)Cl)S

Isomeric SMILES

COC1CNN(C1)SC(=O)NC2=CC(=C(C=C2F)Cl)S

InChI

InChI=1S/C11H13ClFN3O2S2/c1-18-6-4-14-16(5-6)20-11(17)15-9-3-10(19)7(12)2-8(9)13/h2-3,6,14,19H,4-5H2,1H3,(H,15,17)