N-(2-methylphenyl)-4-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-1H-quinoline-6-sulfonamide

Systemtic Name: N-(2-methylphenyl)-4-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-1H-quinoline-6-sulfonamide Openeye Name: N-(o-tolyl)-4-oxo-3-(pyrrolidine-1-carbonyl)-1H-quinoline-6-sulfonamide CAS Name: N-(2-methylphenyl)-4-oxo-3-[oxo(1-pyrrolidinyl)methyl]-1H-quinoline-6-sulfonamide IUPAC Name: N-(2-methylphenyl)-4-oxo-3-(pyrrolidine-1-carbonyl)-1H-quinoline-6-sulfonamide Traditional Name: 4-keto-N-(o-tolyl)-3-(pyrrolidine-1-carbonyl)-1H-quinoline-6-sulfonamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCCC4

InChI

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