methyl N-(4-methylphenyl)-N'-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N-(4-methylphenyl)-N'-(phenylsulfonyl)carbamimidothioate Openeye Name: 3-(benzenesulfonyl)-2-methyl-1-(p-tolyl)isothiourea CAS Name: N'-(benzenesulfonyl)-N-(4-methylphenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(benzenesulfonyl)-N-(4-methylphenyl)carbamimidothioate Traditional Name: 3-besyl-2-methyl-1-(p-tolyl)isothiourea Formula: C15H16N2O2S2 MolecularWeight: 320.42974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=N/S(=O)(=O)C2=CC=CC=C2)/SC

InChI

InChI=1S/C15H16N2O2S2/c1-12-8-10-13(11-9-12)16-15(20-2)17-21(18,19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,16,17)