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

Systemtic Name: 1-ethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-6-piperidin-1-ylsulfonyl-quinolin-4-one Openeye Name: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-(1-piperidylsulfonyl)quinolin-4-one CAS Name: 1-ethyl-3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-6-(1-piperidinylsulfonyl)-4-quinolinone IUPAC Name: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-piperidin-1-ylsulfonylquinolin-4-one Traditional Name: 1-ethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-piperidinosulfonyl-4-quinolone Formula: C27H31FN4O4S MolecularWeight: 526.622843

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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=C(C=C5)F

Isomeric SMILES

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

InChI

InChI=1S/C27H31FN4O4S/c1-2-29-19-24(27(34)31-16-14-30(15-17-31)21-8-6-20(28)7-9-21)26(33)23-18-22(10-11-25(23)29)37(35,36)32-12-4-3-5-13-32/h6-11,18-19H,2-5,12-17H2,1H3