3-[[(4-nitrophenyl)amino]methyl]-1H-benzimidazole-2-thione

Systemtic Name: 3-[[(4-nitrophenyl)amino]methyl]-1H-benzimidazole-2-thione Openeye Name: 3-[(4-nitroanilino)methyl]-1H-benzimidazole-2-thione CAS Name: 3-[(4-nitroanilino)methyl]-1H-benzimidazole-2-thione IUPAC Name: 3-[(4-nitroanilino)methyl]-1H-benzimidazole-2-thione Traditional Name: 3-[(4-nitroanilino)methyl]-1H-benzimidazole-2-thione Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=S)N2CNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=S)N2CNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O2S/c19-18(20)11-7-5-10(6-8-11)15-9-17-13-4-2-1-3-12(13)16-14(17)21/h1-8,15H,9H2,(H,16,21)