2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-[(4-methyl-1-piperidyl)sulfonyl]-1-oxo-2-isoquinolyl]-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-[(4-methyl-1-piperidinyl)sulfonyl]-1-oxo-2-isoquinolinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxoisoquinolin-2-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[1-keto-4-(4-methylpiperidino)sulfonyl-2-isoquinolyl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C24H24F3N3O4S MolecularWeight: 507.52527

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CN(C(=O)C3=CC=CC=C32)CC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CN(C(=O)C3=CC=CC=C32)CC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H24F3N3O4S/c1-16-9-11-30(12-10-16)35(33,34)21-14-29(23(32)20-8-3-2-7-19(20)21)15-22(31)28-18-6-4-5-17(13-18)24(25,26)27/h2-8,13-14,16H,9-12,15H2,1H3,(H,28,31)