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

Systemtic Name: 4-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C13H12N6O2S2 MolecularWeight: 348.40338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NN=C(N2C3CC3)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NN=C(N2C3CC3)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O2S2/c1-17-7-14-11(19(20)21)12(17)23-13-16-15-10(9-3-2-6-22-9)18(13)8-4-5-8/h2-3,6-8H,4-5H2,1H3