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

Systemtic Name: 1-[1-(4-methylphenyl)-7-[(5-thiomorpholin-4-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 1-[1-(p-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[1-(4-methylphenyl)-7-[[5-[oxo(thiomorpholin-4-yl)methyl]-2-furanyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[1-(4-methylphenyl)-7-[[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[1-(p-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C)C=CC(=C3)OCC4=CC=C(O4)C(=O)N5CCSCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C)C=CC(=C3)OCC4=CC=C(O4)C(=O)N5CCSCC5

InChI

InChI=1S/C28H30N2O4S/c1-19-3-5-22(6-4-19)27-25-17-23(8-7-21(25)11-12-30(27)20(2)31)33-18-24-9-10-26(34-24)28(32)29-13-15-35-16-14-29/h3-10,17,27H,11-16,18H2,1-2H3