1-[6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one

Systemtic Name: 1-[6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Openeye Name: 1-[6-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one CAS Name: 1-[6-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinolin-1-yl]-1-propanone IUPAC Name: 1-[6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Traditional Name: 1-[6-[4-(2-pyridyl)piperazino]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H26N4O3S/c1-2-21(26)25-11-5-6-17-16-18(8-9-19(17)25)29(27,28)24-14-12-23(13-15-24)20-7-3-4-10-22-20/h3-4,7-10,16H,2,5-6,11-15H2,1H3