3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 3-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-(4-tosylpiperazine-1-carbonyl)carbostyril Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H21N3O4S/c1-15-6-8-17(9-7-15)29(27,28)24-12-10-23(11-13-24)21(26)18-14-16-4-2-3-5-19(16)22-20(18)25/h2-9,14H,10-13H2,1H3,(H,22,25)