5-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1-phenyl-1,2,4-triazole

Systemtic Name: 5-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1-phenyl-1,2,4-triazole Openeye Name: 5-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1-phenyl-1,2,4-triazole CAS Name: 5-cyclopropyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-1-phenyl-1,2,4-triazole IUPAC Name: 5-cyclopropyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-1-phenyl-1,2,4-triazole Traditional Name: 5-cyclopropyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-1-phenyl-1,2,4-triazole Formula: C15H14N6O2S MolecularWeight: 342.37566

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NN(C(=N2)C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NN(C(=N2)C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O2S/c1-19-9-16-13(21(22)23)14(19)24-15-17-12(10-7-8-10)20(18-15)11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3