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

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-4-[(E)-(4-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-4-[(E)-(4-nitrophenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-4-[(E)-(4-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-4-[(E)-(4-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-4-[(E)-(4-nitrobenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C14H13N7O2S MolecularWeight: 343.36372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NNC(=S)N2N=CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=NNC(=S)N2/N=C/C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C14H13N7O2S/c1-9-7-10(2)19(18-9)13-16-17-14(24)20(13)15-8-11-3-5-12(6-4-11)21(22)23/h3-8H,1-2H3,(H,17,24)/b15-8+