N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-morpholinosulfonyl-4-oxo-N-(p-tolylmethyl)-1H-quinoline-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-6-(4-morpholinylsulfonyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 4-keto-N-(4-methylbenzyl)-6-morpholinosulfonyl-1H-quinoline-3-carboxamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H23N3O5S/c1-15-2-4-16(5-3-15)13-24-22(27)19-14-23-20-7-6-17(12-18(20)21(19)26)31(28,29)25-8-10-30-11-9-25/h2-7,12,14H,8-11,13H2,1H3,(H,23,26)(H,24,27)