N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H33N3O5S/c1-25(2,27-11-10-19-6-4-5-7-20(19)17-27)18-26-24(29)22-16-21(8-9-23(22)32-3)34(30,31)28-12-14-33-15-13-28/h4-9,16H,10-15,17-18H2,1-3H3,(H,26,29)