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

Systemtic Name: 4-methyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-phenyl-1,2,4-triazole Openeye Name: 4-methyl-3-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-5-phenyl-1,2,4-triazole CAS Name: 4-methyl-3-[(3-methyl-5-nitro-4-imidazolyl)thio]-5-phenyl-1,2,4-triazole IUPAC Name: 4-methyl-3-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-5-phenyl-1,2,4-triazole Traditional Name: 4-methyl-3-[(3-methyl-5-nitro-imidazol-4-yl)thio]-5-phenyl-1,2,4-triazole Formula: C13H12N6O2S MolecularWeight: 316.33838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NN=C(N2C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NN=C(N2C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O2S/c1-17-8-14-11(19(20)21)12(17)22-13-16-15-10(18(13)2)9-6-4-3-5-7-9/h3-8H,1-2H3