5-[[3,4-bis(fluoranyl)phenyl]methyl]-7-methyl-2-(3-phenylprop-1-ynyl)thieno[2,3-b]pyridin-6-one

Systemtic Name: 5-[[3,4-bis(fluoranyl)phenyl]methyl]-7-methyl-2-(3-phenylprop-1-ynyl)thieno[2,3-b]pyridin-6-one Openeye Name: 5-[(3,4-difluorophenyl)methyl]-7-methyl-2-(3-phenylprop-1-ynyl)thieno[2,3-b]pyridin-6-one CAS Name: 5-[(3,4-difluorophenyl)methyl]-7-methyl-2-(3-phenylprop-1-ynyl)-6-thieno[2,3-b]pyridinone IUPAC Name: 5-[(3,4-difluorophenyl)methyl]-7-methyl-2-(3-phenylprop-1-ynyl)thieno[2,3-b]pyridin-6-one Traditional Name: 5-(3,4-difluorobenzyl)-7-methyl-2-(3-phenylprop-1-ynyl)thieno[2,3-b]pyridin-6-one Formula: C24H17F2NOS MolecularWeight: 405.459686

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C1=O)CC3=CC(=C(C=C3)F)F)C=C(S2)C#CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C1=O)CC3=CC(=C(C=C3)F)F)C=C(S2)C#CCC4=CC=CC=C4

InChI

InChI=1S/C24H17F2NOS/c1-27-23(28)18(12-17-10-11-21(25)22(26)13-17)14-19-15-20(29-24(19)27)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-11,13-15H,8,12H2,1H3