3-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 3-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazine-1-carbonyl]carbostyril Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O)C)C(C)(C)C

InChI

InChI=1S/C26H31N3O4S/c1-17-14-20(26(3,4)5)15-18(2)23(17)34(32,33)29-12-10-28(11-13-29)25(31)21-16-19-8-6-7-9-22(19)27-24(21)30/h6-9,14-16H,10-13H2,1-5H3,(H,27,30)