(2-chlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate

Systemtic Name: (2-chlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Openeye Name: 2-[(2-chlorophenyl)methyl]-3-(3,4-dimethylphenyl)isothiourea CAS Name: N'-(3,4-dimethylphenyl)carbamimidothioic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Traditional Name: 2-(2-chlorobenzyl)-3-(3,4-dimethylphenyl)isothiourea Formula: C16H17ClN2S MolecularWeight: 304.83758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C(N)SCC2=CC=CC=C2Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C(N)SCC2=CC=CC=C2Cl)C

InChI

InChI=1S/C16H17ClN2S/c1-11-7-8-14(9-12(11)2)19-16(18)20-10-13-5-3-4-6-15(13)17/h3-9H,10H2,1-2H3,(H2,18,19)