2-(aminomethyl)-N-[(2-phenylsulfanylphenyl)methyl]-3H-benzimidazol-5-amine

Systemtic Name: 2-(aminomethyl)-N-[(2-phenylsulfanylphenyl)methyl]-3H-benzimidazol-5-amine Openeye Name: 2-(aminomethyl)-N-[(2-phenylsulfanylphenyl)methyl]-3H-benzimidazol-5-amine CAS Name: 2-(aminomethyl)-N-[[2-(phenylthio)phenyl]methyl]-3H-benzimidazol-5-amine IUPAC Name: 2-(aminomethyl)-N-[(2-phenylsulfanylphenyl)methyl]-3H-benzimidazol-5-amine Traditional Name: [2-(aminomethyl)-3H-benzimidazol-5-yl]-[2-(phenylthio)benzyl]amine Formula: C21H20N4S MolecularWeight: 360.4753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2CNC3=CC4=C(C=C3)N=C(N4)CN

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2CNC3=CC4=C(C=C3)N=C(N4)CN

InChI

InChI=1S/C21H20N4S/c22-13-21-24-18-11-10-16(12-19(18)25-21)23-14-15-6-4-5-9-20(15)26-17-7-2-1-3-8-17/h1-12,23H,13-14,22H2,(H,24,25)