6-(azepan-1-ylsulfonyl)-3-(2,3-dihydroindol-1-ylcarbonyl)-1-ethyl-quinolin-4-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-(2,3-dihydroindol-1-ylcarbonyl)-1-ethyl-quinolin-4-one Openeye Name: 6-(azepan-1-ylsulfonyl)-1-ethyl-3-(indoline-1-carbonyl)quinolin-4-one CAS Name: 6-(1-azepanylsulfonyl)-3-[2,3-dihydroindol-1-yl(oxo)methyl]-1-ethyl-4-quinolinone IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-(2,3-dihydroindole-1-carbonyl)-1-ethylquinolin-4-one Traditional Name: 6-(azepan-1-ylsulfonyl)-1-ethyl-3-(indoline-1-carbonyl)-4-quinolone Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O4S/c1-2-27-18-22(26(31)29-16-13-19-9-5-6-10-23(19)29)25(30)21-17-20(11-12-24(21)27)34(32,33)28-14-7-3-4-8-15-28/h5-6,9-12,17-18H,2-4,7-8,13-16H2,1H3