4-[(E)-(2-methoxy-5-nitro-phenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(2-methoxy-5-nitro-phenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(2-methoxy-5-nitro-phenyl)methyleneamino]-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(2-methoxy-5-nitrophenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(2-methoxy-5-nitrophenyl)methylideneamino]-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(2-methoxy-5-nitro-benzylidene)amino]-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C=NN2C(=NNC2=S)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])/C=N/N2C(=NNC2=S)C3=CC=CC=C3

InChI

InChI=1S/C16H13N5O3S/c1-24-14-8-7-13(21(22)23)9-12(14)10-17-20-15(18-19-16(20)25)11-5-3-2-4-6-11/h2-10H,1H3,(H,19,25)/b17-10+