N-methyl-N-(3-methylphenyl)-4-oxidanylidene-3-(4-phenylpiperazin-1-yl)carbonyl-1H-quinoline-6-sulfonamide

Systemtic Name: N-methyl-N-(3-methylphenyl)-4-oxidanylidene-3-(4-phenylpiperazin-1-yl)carbonyl-1H-quinoline-6-sulfonamide Openeye Name: N-methyl-N-(m-tolyl)-4-oxo-3-(4-phenylpiperazine-1-carbonyl)-1H-quinoline-6-sulfonamide CAS Name: N-methyl-N-(3-methylphenyl)-4-oxo-3-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-quinoline-6-sulfonamide IUPAC Name: N-methyl-N-(3-methylphenyl)-4-oxo-3-(4-phenylpiperazine-1-carbonyl)-1H-quinoline-6-sulfonamide Traditional Name: 4-keto-N-methyl-N-(m-tolyl)-3-(4-phenylpiperazine-1-carbonyl)-1H-quinoline-6-sulfonamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O4S/c1-20-7-6-10-22(17-20)30(2)37(35,36)23-11-12-26-24(18-23)27(33)25(19-29-26)28(34)32-15-13-31(14-16-32)21-8-4-3-5-9-21/h3-12,17-19H,13-16H2,1-2H3,(H,29,33)