(3,4-dichlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate

Systemtic Name: (3,4-dichlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Openeye Name: 2-[(3,4-dichlorophenyl)methyl]-3-(3,4-dimethylphenyl)isothiourea CAS Name: N'-(3,4-dimethylphenyl)carbamimidothioic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Traditional Name: 2-(3,4-dichlorobenzyl)-3-(3,4-dimethylphenyl)isothiourea Formula: C16H16Cl2N2S MolecularWeight: 339.28264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C(N)SCC2=CC(=C(C=C2)Cl)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C(N)SCC2=CC(=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C16H16Cl2N2S/c1-10-3-5-13(7-11(10)2)20-16(19)21-9-12-4-6-14(17)15(18)8-12/h3-8H,9H2,1-2H3,(H2,19,20)