N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-isopropylsulfanylphenyl)acetamide CAS Name: N-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-[4-(isopropylthio)phenyl]acetamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4CC4)C=C2

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4CC4)C=C2

InChI

InChI=1S/C24H28N2O2S/c1-16(2)29-22-9-3-17(4-10-22)13-23(27)25-21-8-7-18-11-12-26(15-20(18)14-21)24(28)19-5-6-19/h3-4,7-10,14,16,19H,5-6,11-13,15H2,1-2H3,(H,25,27)