N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]quinoline-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]quinoline-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]quinoline-4-carboxamide CAS Name: N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]-4-quinolinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]quinoline-4-carboxamide Traditional Name: N-(2-methoxyphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]cinchoninamide Formula: C25H19N5O2S MolecularWeight: 453.51566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NN=CN4C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NN=CN4C5=CC=CC=C5

InChI

InChI=1S/C25H19N5O2S/c1-32-22-14-8-7-13-21(22)28-24(31)19-15-23(27-20-12-6-5-11-18(19)20)33-25-29-26-16-30(25)17-9-3-2-4-10-17/h2-16H,1H3,(H,28,31)