3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrophenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-methyl-1H-pyrazol-3-yl)-4-[(E)-(3-nitrobenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C13H11N7O2S MolecularWeight: 329.33714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1)C2=NNC(=S)N2/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N7O2S/c1-8-5-11(16-15-8)12-17-18-13(23)19(12)14-7-9-3-2-4-10(6-9)20(21)22/h2-7H,1H3,(H,15,16)(H,18,23)/b14-7+