2-[4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-(2-methoxyethyl)ethanamide

Systemtic Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-1-oxidanylidene-isoquinolin-2-yl]-N-(2-methoxyethyl)ethanamide Openeye Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-1-oxo-2-isoquinolyl]-N-(2-methoxyethyl)acetamide CAS Name: 2-[4-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-1-oxo-2-isoquinolinyl]-N-(2-methoxyethyl)acetamide IUPAC Name: 2-[4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-1-oxoisoquinolin-2-yl]-N-(2-methoxyethyl)acetamide Traditional Name: 2-[4-[4-(2-fluorophenyl)piperazino]sulfonyl-1-keto-2-isoquinolyl]-N-(2-methoxyethyl)acetamide Formula: C24H27FN4O5S MolecularWeight: 502.558383

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CN1C=C(C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COCCNC(=O)CN1C=C(C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C24H27FN4O5S/c1-34-15-10-26-23(30)17-28-16-22(18-6-2-3-7-19(18)24(28)31)35(32,33)29-13-11-27(12-14-29)21-9-5-4-8-20(21)25/h2-9,16H,10-15,17H2,1H3,(H,26,30)