4-(4-ethoxy-2-nitro-phenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-ethoxy-2-nitro-phenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-ethoxy-2-nitro-phenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-ethoxy-2-nitrophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-ethoxy-2-nitrophenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-ethoxy-2-nitro-phenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C19H16N6O3S MolecularWeight: 408.43374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N6O3S/c1-2-28-13-8-9-16(17(10-13)25(26)27)24-18(22-23-19(24)29)15-11-14(20-21-15)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,20,21)(H,23,29)