methyl N-(3-chlorophenyl)-N'-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N-(3-chlorophenyl)-N'-(phenylsulfonyl)carbamimidothioate Openeye Name: 3-(benzenesulfonyl)-1-(3-chlorophenyl)-2-methyl-isothiourea CAS Name: N'-(benzenesulfonyl)-N-(3-chlorophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(benzenesulfonyl)-N-(3-chlorophenyl)carbamimidothioate Traditional Name: 3-besyl-1-(3-chlorophenyl)-2-methyl-isothiourea Formula: C14H13ClN2O2S2 MolecularWeight: 340.84822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=CC=C1)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=CC=C1)/NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H13ClN2O2S2/c1-20-14(16-12-7-5-6-11(15)10-12)17-21(18,19)13-8-3-2-4-9-13/h2-10H,1H3,(H,16,17)