4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[oxo-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-quinolin-2-one IUPAC Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-(4-mesitylsulfonylpiperazine-1-carbonyl)carbostyril Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C23H25N3O4S/c1-15-12-16(2)22(17(3)13-15)31(29,30)26-10-8-25(9-11-26)23(28)19-14-21(27)24-20-7-5-4-6-18(19)20/h4-7,12-14H,8-11H2,1-3H3,(H,24,27)