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

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-ethyl-6-piperidin-1-ylsulfonyl-quinolin-4-one Openeye Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(1-piperidylsulfonyl)quinolin-4-one CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-ethyl-6-(1-piperidinylsulfonyl)-4-quinolinone IUPAC Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-piperidin-1-ylsulfonylquinolin-4-one Traditional Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-piperidinosulfonyl-4-quinolone Formula: C27H31ClN4O4S MolecularWeight: 543.07744

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H31ClN4O4S/c1-2-29-19-24(27(34)31-15-13-30(14-16-31)21-8-6-7-20(28)17-21)26(33)23-18-22(9-10-25(23)29)37(35,36)32-11-4-3-5-12-32/h6-10,17-19H,2-5,11-16H2,1H3