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

Systemtic Name: 3-ethyl-4-[(Z)-(4-methyl-3-nitro-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[(Z)-(4-methyl-3-nitro-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[(Z)-(4-methyl-3-nitro-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O2S/c1-3-11-14-15-12(20)16(11)13-7-9-5-4-8(2)10(6-9)17(18)19/h4-7H,3H2,1-2H3,(H,15,20)/b13-7-