2-(4-isothiocyanato-2-methyl-phenyl)-1-(2-methylphenyl)guanidine

Systemtic Name: 2-(4-isothiocyanato-2-methyl-phenyl)-1-(2-methylphenyl)guanidine Openeye Name: 2-(4-isothiocyanato-2-methyl-phenyl)-1-(o-tolyl)guanidine CAS Name: 2-(4-isothiocyanato-2-methylphenyl)-1-(2-methylphenyl)guanidine IUPAC Name: 2-(4-isothiocyanato-2-methylphenyl)-1-(2-methylphenyl)guanidine Traditional Name: 2-(4-isothiocyanato-2-methyl-phenyl)-1-(o-tolyl)guanidine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=NC2=C(C=C(C=C2)N=C=S)C)N

Isomeric SMILES

CC1=CC=CC=C1NC(=NC2=C(C=C(C=C2)N=C=S)C)N

InChI

InChI=1S/C16H16N4S/c1-11-5-3-4-6-14(11)19-16(17)20-15-8-7-13(18-10-21)9-12(15)2/h3-9H,1-2H3,(H3,17,19,20)