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

Systemtic Name: 4-(4-ethoxy-2-nitro-phenyl)-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-ethoxy-2-nitro-phenyl)-3-(2-quinolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-ethoxy-2-nitrophenyl)-3-(2-quinolinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-ethoxy-2-nitrophenyl)-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-ethoxy-2-nitro-phenyl)-3-(2-quinolyl)-1H-1,2,4-triazole-5-thione Formula: C19H15N5O3S MolecularWeight: 393.4191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=NNC2=S)C3=NC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=NNC2=S)C3=NC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O3S/c1-2-27-13-8-10-16(17(11-13)24(25)26)23-18(21-22-19(23)28)15-9-7-12-5-3-4-6-14(12)20-15/h3-11H,2H2,1H3,(H,22,28)