N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylphenoxy)ethanamide

Systemtic Name: N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylphenoxy)ethanamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-isopropylphenoxy)acetamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylphenoxy)acetamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylphenoxy)acetamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(4-isopropylphenoxy)acetamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O4S/c1-19(2)20-9-12-24(13-10-20)32-18-26(29)27-23-11-8-21-14-15-28(17-22(21)16-23)33(30,31)25-6-4-3-5-7-25/h3-13,16,19H,14-15,17-18H2,1-2H3,(H,27,29)