(3-chlorophenyl) N-(4-methylphenyl)-3,3-bis[(4-methylphenyl)sulfanyl]propanimidothioate

Systemtic Name: (3-chlorophenyl) N-(4-methylphenyl)-3,3-bis[(4-methylphenyl)sulfanyl]propanimidothioate Openeye Name: (3-chlorophenyl) N-(p-tolyl)-3,3-bis(p-tolylsulfanyl)propanimidothioate CAS Name: N-(4-methylphenyl)-3,3-bis[(4-methylphenyl)thio]propanimidothioic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) N-(4-methylphenyl)-3,3-bis[(4-methylphenyl)sulfanyl]propanimidothioate Traditional Name: N-(p-tolyl)-3,3-bis(p-tolylthio)thiopropionimidic acid (3-chlorophenyl) ester Formula: C30H28ClNS3 MolecularWeight: 534.19802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(CC(SC2=CC=C(C=C2)C)SC3=CC=C(C=C3)C)SC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N=C(CC(SC2=CC=C(C=C2)C)SC3=CC=C(C=C3)C)SC4=CC(=CC=C4)Cl

InChI

InChI=1S/C30H28ClNS3/c1-21-7-13-25(14-8-21)32-29(33-28-6-4-5-24(31)19-28)20-30(34-26-15-9-22(2)10-16-26)35-27-17-11-23(3)12-18-27/h4-19,30H,20H2,1-3H3