2-[[2-cyclopropylcarbonyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholin-4-yl-ethanone

Systemtic Name: 2-[[2-cyclopropylcarbonyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholin-4-yl-ethanone Openeye Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholino-ethanone CAS Name: 2-[[2-[cyclopropyl(oxo)methyl]-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholin-4-ylethanone IUPAC Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholin-4-ylethanone Traditional Name: 2-[[2-(cyclopropanecarbonyl)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-thiomorpholino-ethanone Formula: C25H27FN2O3S MolecularWeight: 454.556883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC3=C(C2C4=CC=C(C=C4)F)C=C(C=C3)OCC(=O)N5CCSCC5

Isomeric SMILES

C1CC1C(=O)N2CCC3=C(C2C4=CC=C(C=C4)F)C=C(C=C3)OCC(=O)N5CCSCC5

InChI

InChI=1S/C25H27FN2O3S/c26-20-6-3-18(4-7-20)24-22-15-21(31-16-23(29)27-11-13-32-14-12-27)8-5-17(22)9-10-28(24)25(30)19-1-2-19/h3-8,15,19,24H,1-2,9-14,16H2