3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 3-[4-(4-butan-2-ylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]carbostyril Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H27N3O4S/c1-3-17(2)18-8-10-20(11-9-18)32(30,31)27-14-12-26(13-15-27)24(29)21-16-19-6-4-5-7-22(19)25-23(21)28/h4-11,16-17H,3,12-15H2,1-2H3,(H,25,28)