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

Systemtic Name: 1-[1-(4-methylphenyl)-7-[(5-thiomorpholin-4-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 1-[1-(p-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 1-[1-(4-methylphenyl)-7-[[5-[oxo(thiomorpholin-4-yl)methyl]-2-furanyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 1-[1-(4-methylphenyl)-7-[[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[1-(p-tolyl)-7-[[5-(thiomorpholine-4-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Formula: C29H32N2O4S MolecularWeight: 504.64038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCSCC5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCSCC5

InChI

InChI=1S/C29H32N2O4S/c1-3-27(32)31-13-12-21-8-9-23(18-25(21)28(31)22-6-4-20(2)5-7-22)34-19-24-10-11-26(35-24)29(33)30-14-16-36-17-15-30/h4-11,18,28H,3,12-17,19H2,1-2H3