methyl N'-[(3-methylphenyl)-phenyl-methyl]carbamimidothioate

Systemtic Name: methyl N'-[(3-methylphenyl)-phenyl-methyl]carbamimidothioate Openeye Name: 2-methyl-3-[m-tolyl(phenyl)methyl]isothiourea CAS Name: N'-[(3-methylphenyl)-phenylmethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(3-methylphenyl)-phenylmethyl]carbamimidothioate Traditional Name: 2-methyl-3-[m-tolyl(phenyl)methyl]isothiourea Formula: C16H18N2S MolecularWeight: 270.39252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)N=C(N)SC

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)N=C(N)SC

InChI

InChI=1S/C16H18N2S/c1-12-7-6-10-14(11-12)15(18-16(17)19-2)13-8-4-3-5-9-13/h3-11,15H,1-2H3,(H2,17,18)