3,3-bis(1,3-dioxolan-2-ylmethylsulfanyl)-1-(4-fluorophenyl)-2-pyridin-4-yl-prop-2-en-1-one

Systemtic Name: 3,3-bis(1,3-dioxolan-2-ylmethylsulfanyl)-1-(4-fluorophenyl)-2-pyridin-4-yl-prop-2-en-1-one Openeye Name: 3,3-bis(1,3-dioxolan-2-ylmethylsulfanyl)-1-(4-fluorophenyl)-2-(4-pyridyl)prop-2-en-1-one CAS Name: 3,3-bis(1,3-dioxolan-2-ylmethylthio)-1-(4-fluorophenyl)-2-pyridin-4-yl-2-propen-1-one IUPAC Name: 3,3-bis(1,3-dioxolan-2-ylmethylsulfanyl)-1-(4-fluorophenyl)-2-pyridin-4-ylprop-2-en-1-one Traditional Name: 3,3-bis(1,3-dioxolan-2-ylmethylthio)-1-(4-fluorophenyl)-2-(4-pyridyl)prop-2-en-1-one Formula: C22H22FNO5S2 MolecularWeight: 463.542183

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)CSC(=C(C2=CC=NC=C2)C(=O)C3=CC=C(C=C3)F)SCC4OCCO4

Isomeric SMILES

C1COC(O1)CSC(=C(C2=CC=NC=C2)C(=O)C3=CC=C(C=C3)F)SCC4OCCO4

InChI

InChI=1S/C22H22FNO5S2/c23-17-3-1-16(2-4-17)21(25)20(15-5-7-24-8-6-15)22(30-13-18-26-9-10-27-18)31-14-19-28-11-12-29-19/h1-8,18-19H,9-14H2