(phenylmethyl) N'-methyl-N-[(2-methylphenyl)methyl]carbamimidothioate hydrochloride

Systemtic Name: (phenylmethyl) N'-methyl-N-[(2-methylphenyl)methyl]carbamimidothioate hydrochloride Openeye Name: 2-benzyl-3-methyl-1-(o-tolylmethyl)isothiourea hydrochloride CAS Name: N'-methyl-N-[(2-methylphenyl)methyl]carbamimidothioic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N'-methyl-N-[(2-methylphenyl)methyl]carbamimidothioate hydrochloride Traditional Name: 2-benzyl-3-methyl-1-(2-methylbenzyl)isothiourea hydrochloride Formula: C17H21ClN2S MolecularWeight: 320.88004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=NC)SCC2=CC=CC=C2.Cl

Isomeric SMILES

CC1=CC=CC=C1CNC(=NC)SCC2=CC=CC=C2.Cl

InChI

InChI=1S/C17H20N2S.ClH/c1-14-8-6-7-11-16(14)12-19-17(18-2)20-13-15-9-4-3-5-10-15;/h3-11H,12-13H2,1-2H3,(H,18,19);1H