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

Systemtic Name: 5-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-1,2,4-triazole Openeye Name: 5-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-1,2,4-triazole CAS Name: 5-cyclopropyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-1H-1,2,4-triazole IUPAC Name: 5-cyclopropyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-1H-1,2,4-triazole Traditional Name: 5-cyclopropyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-1H-1,2,4-triazole Formula: C9H10N6O2S MolecularWeight: 266.2797

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NNC(=N2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NNC(=N2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C9H10N6O2S/c1-14-4-10-7(15(16)17)8(14)18-9-11-6(12-13-9)5-2-3-5/h4-5H,2-3H2,1H3,(H,11,12,13)