cyclopentyl-[1-(3-methylphenyl)-7-[(5-thiomorpholin-4-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Systemtic Name: cyclopentyl-[1-(3-methylphenyl)-7-[(5-thiomorpholin-4-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: cyclopentyl-[1-(m-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: cyclopentyl-[1-(3-methylphenyl)-7-[[5-[oxo(thiomorpholin-4-yl)methyl]-2-furanyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: cyclopentyl-[1-(3-methylphenyl)-7-[[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: cyclopentyl-[1-(m-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C32H36N2O4S MolecularWeight: 544.70424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=C(CCN2C(=O)C4CCCC4)C=CC(=C3)OCC5=CC=C(O5)C(=O)N6CCSCC6

Isomeric SMILES

CC1=CC=CC(=C1)C2C3=C(CCN2C(=O)C4CCCC4)C=CC(=C3)OCC5=CC=C(O5)C(=O)N6CCSCC6

InChI

InChI=1S/C32H36N2O4S/c1-22-5-4-8-25(19-22)30-28-20-26(10-9-23(28)13-14-34(30)31(35)24-6-2-3-7-24)37-21-27-11-12-29(38-27)32(36)33-15-17-39-18-16-33/h4-5,8-12,19-20,24,30H,2-3,6-7,13-18,21H2,1H3