(2-methylphenyl)methyl N'-(3,5-dimethylphenyl)carbamimidothioate

Systemtic Name: (2-methylphenyl)methyl N'-(3,5-dimethylphenyl)carbamimidothioate Openeye Name: 3-(3,5-dimethylphenyl)-2-(o-tolylmethyl)isothiourea CAS Name: N'-(3,5-dimethylphenyl)carbamimidothioic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl N'-(3,5-dimethylphenyl)carbamimidothioate Traditional Name: 3-(3,5-dimethylphenyl)-2-(2-methylbenzyl)isothiourea Formula: C17H20N2S MolecularWeight: 284.4191

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC(=NC2=CC(=CC(=C2)C)C)N

Isomeric SMILES

CC1=CC=CC=C1CSC(=NC2=CC(=CC(=C2)C)C)N

InChI

InChI=1S/C17H20N2S/c1-12-8-13(2)10-16(9-12)19-17(18)20-11-15-7-5-4-6-14(15)3/h4-10H,11H2,1-3H3,(H2,18,19)