3-phenylsulfanyl-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one

Systemtic Name: 3-phenylsulfanyl-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one Openeye Name: 3-phenylsulfanyl-1-[2-[[5-(trifluoromethyl)-2-pyridyl]oxymethyl]morpholin-4-yl]prop-2-en-1-one CAS Name: 3-(phenylthio)-1-[2-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-4-morpholinyl]-2-propen-1-one IUPAC Name: 3-phenylsulfanyl-1-[2-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]morpholin-4-yl]prop-2-en-1-one Traditional Name: 3-(phenylthio)-1-[2-[[5-(trifluoromethyl)-2-pyridyl]oxymethyl]morpholino]prop-2-en-1-one Formula: C20H19F3N2O3S MolecularWeight: 424.43667

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)C=CSC2=CC=CC=C2)COC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1COC(CN1C(=O)C=CSC2=CC=CC=C2)COC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H19F3N2O3S/c21-20(22,23)15-6-7-18(24-12-15)28-14-16-13-25(9-10-27-16)19(26)8-11-29-17-4-2-1-3-5-17/h1-8,11-12,16H,9-10,13-14H2