2-(4-propan-2-ylsulfonylphenyl)-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-(4-propan-2-ylsulfonylphenyl)-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(4-isopropylsulfonylphenyl)-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide CAS Name: N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylsulfonylphenyl)acetamide IUPAC Name: 2-(4-propan-2-ylsulfonylphenyl)-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Traditional Name: 2-(4-isopropylsulfonylphenyl)-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

InChI

InChI=1S/C25H26N2O4S2/c1-17(2)33(30,31)22-9-5-18(6-10-22)14-24(28)26-21-8-7-19-11-12-27(16-20(19)15-21)25(29)23-4-3-13-32-23/h3-10,13,15,17H,11-12,14,16H2,1-2H3,(H,26,28)