(phenylmethyl) N'-(2,5-dimethylphenyl)carbamimidothioate

Systemtic Name: (phenylmethyl) N'-(2,5-dimethylphenyl)carbamimidothioate Openeye Name: 2-benzyl-3-(2,5-dimethylphenyl)isothiourea CAS Name: N'-(2,5-dimethylphenyl)carbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N'-(2,5-dimethylphenyl)carbamimidothioate Traditional Name: 2-benzyl-3-(2,5-dimethylphenyl)isothiourea Formula: C16H18N2S MolecularWeight: 270.39252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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