3-(azepan-1-ylcarbonyl)-1-methyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-4-one

Systemtic Name: 3-(azepan-1-ylcarbonyl)-1-methyl-6-(4-methylpiperidin-1-yl)sulfonyl-quinolin-4-one Openeye Name: 3-(azepane-1-carbonyl)-1-methyl-6-[(4-methyl-1-piperidyl)sulfonyl]quinolin-4-one CAS Name: 3-[1-azepanyl(oxo)methyl]-1-methyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-4-quinolinone IUPAC Name: 3-(azepane-1-carbonyl)-1-methyl-6-(4-methylpiperidin-1-yl)sulfonylquinolin-4-one Traditional Name: 3-(azepane-1-carbonyl)-1-methyl-6-(4-methylpiperidino)sulfonyl-4-quinolone Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C(C3=O)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C(C3=O)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C23H31N3O4S/c1-17-9-13-26(14-10-17)31(29,30)18-7-8-21-19(15-18)22(27)20(16-24(21)2)23(28)25-11-5-3-4-6-12-25/h7-8,15-17H,3-6,9-14H2,1-2H3