N-(8-methylquinolin-5-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(8-methylquinolin-5-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(8-methyl-5-quinolyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(8-methyl-5-quinolinyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(8-methylquinolin-5-yl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-(8-methyl-5-quinolyl)-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C)C=CC=N2

InChI

InChI=1S/C21H21N3O3S/c1-14-7-9-18(17-6-3-11-22-20(14)17)23-21(25)16-8-10-19-15(13-16)5-4-12-24(19)28(2,26)27/h3,6-11,13H,4-5,12H2,1-2H3,(H,23,25)