3-(4-methylphenyl)-5-(4-nitrophenyl)-1H-imidazole-2-thione

Systemtic Name: 3-(4-methylphenyl)-5-(4-nitrophenyl)-1H-imidazole-2-thione Openeye Name: 5-(4-nitrophenyl)-3-(p-tolyl)-1H-imidazole-2-thione CAS Name: 3-(4-methylphenyl)-5-(4-nitrophenyl)-1H-imidazole-2-thione IUPAC Name: 3-(4-methylphenyl)-5-(4-nitrophenyl)-1H-imidazole-2-thione Traditional Name: 4-(4-nitrophenyl)-1-(p-tolyl)-4-imidazoline-2-thione Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(NC2=S)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(NC2=S)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2S/c1-11-2-6-13(7-3-11)18-10-15(17-16(18)22)12-4-8-14(9-5-12)19(20)21/h2-10H,1H3,(H,17,22)