2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-5-propan-2-ylsulfonyl-benzamide

Systemtic Name: 2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-5-propan-2-ylsulfonyl-benzamide Openeye Name: 5-isopropylsulfonyl-2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)benzamide CAS Name: 2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-5-propan-2-ylsulfonylbenzamide IUPAC Name: 2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-5-propan-2-ylsulfonylbenzamide Traditional Name: 5-isopropylsulfonyl-2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)NC2=CC=CC3=C2CCN(C3)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)NC2=CC=CC3=C2CCN(C3)C

InChI

InChI=1S/C21H26N2O4S/c1-14(2)28(25,26)16-8-9-20(27-4)18(12-16)21(24)22-19-7-5-6-15-13-23(3)11-10-17(15)19/h5-9,12,14H,10-11,13H2,1-4H3,(H,22,24)