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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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