3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-2-morpholin-4-yl-pentyl)benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-2-morpholin-4-yl-pentyl)benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-2-morpholino-pentyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-methyl-2-(4-morpholinyl)pentyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-2-morpholino-pentyl)benzamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)N4CCOCC4

Isomeric SMILES

CC(C)CC(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)N4CCOCC4

InChI

InChI=1S/C26H35N3O4S/c1-20(2)16-24(28-12-14-33-15-13-28)18-27-26(30)22-8-5-9-25(17-22)34(31,32)29-11-10-21-6-3-4-7-23(21)19-29/h3-9,17,20,24H,10-16,18-19H2,1-2H3,(H,27,30)