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

Systemtic Name: 2-cyclohexyl-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-cyclohexyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide CAS Name: 2-cyclohexyl-N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetamide IUPAC Name: 2-cyclohexyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Traditional Name: 2-cyclohexyl-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2

InChI

InChI=1S/C22H26N2O2S/c25-21(13-16-5-2-1-3-6-16)23-19-9-8-17-10-11-24(15-18(17)14-19)22(26)20-7-4-12-27-20/h4,7-9,12,14,16H,1-3,5-6,10-11,13,15H2,(H,23,25)