2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Formula: C25H25FN2O4S MolecularWeight: 468.540403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)C=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)C=C2)C

InChI

InChI=1S/C25H25FN2O4S/c1-17-11-18(2)13-23(12-17)32-16-25(29)27-22-6-3-19-9-10-28(15-20(19)14-22)33(30,31)24-7-4-21(26)5-8-24/h3-8,11-14H,9-10,15-16H2,1-2H3,(H,27,29)