2-methyl-1-[1-(4-methylphenyl)-7-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one

Systemtic Name: 2-methyl-1-[1-(4-methylphenyl)-7-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 2-methyl-1-[7-(2-oxo-2-thiomorpholino-ethoxy)-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 2-methyl-1-[1-(4-methylphenyl)-7-(2-oxo-2-thiomorpholin-4-ylethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 2-methyl-1-[1-(4-methylphenyl)-7-(2-oxo-2-thiomorpholin-4-ylethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[7-(2-keto-2-thiomorpholino-ethoxy)-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propan-1-one Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C(C)C)C=CC(=C3)OCC(=O)N4CCSCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)C(C)C)C=CC(=C3)OCC(=O)N4CCSCC4

InChI

InChI=1S/C26H32N2O3S/c1-18(2)26(30)28-11-10-20-8-9-22(31-17-24(29)27-12-14-32-15-13-27)16-23(20)25(28)21-6-4-19(3)5-7-21/h4-9,16,18,25H,10-15,17H2,1-3H3