2-[5-[(4-fluorophenyl)methoxy]isoquinolin-1-yl]sulfanyl-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[5-[(4-fluorophenyl)methoxy]isoquinolin-1-yl]sulfanyl-1-morpholin-4-yl-ethanone Openeye Name: 2-[[5-[(4-fluorophenyl)methoxy]-1-isoquinolyl]sulfanyl]-1-morpholino-ethanone CAS Name: 2-[[5-[(4-fluorophenyl)methoxy]-1-isoquinolinyl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[5-[(4-fluorophenyl)methoxy]isoquinolin-1-yl]sulfanyl-1-morpholin-4-ylethanone Traditional Name: 2-[[5-(4-fluorobenzyl)oxy-1-isoquinolyl]thio]-1-morpholino-ethanone Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC=CC3=C2C=CC=C3OCC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC=CC3=C2C=CC=C3OCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O3S/c23-17-6-4-16(5-7-17)14-28-20-3-1-2-19-18(20)8-9-24-22(19)29-15-21(26)25-10-12-27-13-11-25/h1-9H,10-15H2