2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]ethanone Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C25H33N3O3S/c1-3-20(2)21-10-12-23(13-11-21)32(30,31)27-17-15-26(16-18-27)19-25(29)28-14-6-8-22-7-4-5-9-24(22)28/h4-5,7,9-13,20H,3,6,8,14-19H2,1-2H3