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

Systemtic Name: 2-methyl-1-[7-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 2-methyl-1-[7-(2-oxo-2-thiomorpholino-ethoxy)-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 2-methyl-1-[7-(2-oxo-2-thiomorpholin-4-ylethoxy)-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 2-methyl-1-[7-(2-oxo-2-thiomorpholin-4-ylethoxy)-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[7-(2-keto-2-thiomorpholino-ethoxy)-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-propan-1-one Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)N4CCSCC4

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC(=O)N4CCSCC4

InChI

InChI=1S/C25H30N2O3S/c1-18(2)25(29)27-11-10-19-8-9-21(30-17-23(28)26-12-14-31-15-13-26)16-22(19)24(27)20-6-4-3-5-7-20/h3-9,16,18,24H,10-15,17H2,1-2H3