3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-ethyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-4-one

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-ethyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-4-one Openeye Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-[(4-methyl-1-piperidyl)sulfonyl]quinolin-4-one CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-ethyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-4-quinolinone IUPAC Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(4-methylpiperidin-1-yl)sulfonylquinolin-4-one Traditional Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(4-methylpiperidino)sulfonyl-4-quinolone Formula: C28H33ClN4O4S MolecularWeight: 557.10402

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H33ClN4O4S/c1-3-30-19-25(28(35)32-15-13-31(14-16-32)22-6-4-5-21(29)17-22)27(34)24-18-23(7-8-26(24)30)38(36,37)33-11-9-20(2)10-12-33/h4-8,17-20H,3,9-16H2,1-2H3