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

Systemtic Name: 4-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]-3-methyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-methoxy-3-nitro-benzylidene)amino]-3-methyl-1H-1,2,4-triazole-5-thione Formula: C11H11N5O3S MolecularWeight: 293.30174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1/N=C/C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H11N5O3S/c1-7-13-14-11(20)15(7)12-6-8-3-4-10(19-2)9(5-8)16(17)18/h3-6H,1-2H3,(H,14,20)/b12-6+