3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-6-(4-methylpiperidin-1-yl)sulfonyl-1H-quinolin-4-one

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-6-(4-methylpiperidin-1-yl)sulfonyl-1H-quinolin-4-one Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6-[(4-methyl-1-piperidyl)sulfonyl]-1H-quinolin-4-one CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-6-[(4-methyl-1-piperidinyl)sulfonyl]-1H-quinolin-4-one IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidin-1-yl)sulfonyl-1H-quinolin-4-one Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidino)sulfonyl-4-quinolone Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)C)C

InChI

InChI=1S/C28H34N4O4S/c1-19-8-10-32(11-9-19)37(35,36)22-6-7-25-23(17-22)27(33)24(18-29-25)28(34)31-14-12-30(13-15-31)26-16-20(2)4-5-21(26)3/h4-7,16-19H,8-15H2,1-3H3,(H,29,33)