N-(1-ethanoyl-2,3-dihydroindol-5-yl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(1-ethanoyl-2,3-dihydroindol-5-yl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(1-acetylindolin-5-yl)-2-(4-quinolylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(4-quinolinylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(1-acetylindolin-5-yl)-2-(4-quinolylmethylthio)nicotinamide Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC5=CC=CC=C45

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C26H22N4O2S/c1-17(31)30-14-11-18-15-20(8-9-24(18)30)29-25(32)22-6-4-12-28-26(22)33-16-19-10-13-27-23-7-3-2-5-21(19)23/h2-10,12-13,15H,11,14,16H2,1H3,(H,29,32)