2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[4-[(4-methyl-1-piperidyl)sulfonyl]-1-oxo-2-isoquinolyl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[4-[(4-methyl-1-piperidinyl)sulfonyl]-1-oxo-2-isoquinolinyl]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[4-(4-methylpiperidin-1-yl)sulfonyl-1-oxoisoquinolin-2-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[1-keto-4-(4-methylpiperidino)sulfonyl-2-isoquinolyl]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C26H31N3O7S MolecularWeight: 529.60524

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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(=C(C(=C4)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O7S/c1-17-9-11-29(12-10-17)37(32,33)23-15-28(26(31)20-8-6-5-7-19(20)23)16-24(30)27-18-13-21(34-2)25(36-4)22(14-18)35-3/h5-8,13-15,17H,9-12,16H2,1-4H3,(H,27,30)