6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methyl-thieno[2,3-b]pyridin-5-yl]ethenyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methyl-thieno[2,3-b]pyridin-5-yl]ethenyl]-4-oxidanyl-oxan-2-one Openeye Name: 6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methyl-thieno[2,3-b]pyridin-5-yl]vinyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methyl-5-thieno[2,3-b]pyridinyl]ethenyl]-4-hydroxy-2-oxanone IUPAC Name: 6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methylthieno[2,3-b]pyridin-5-yl]ethenyl]-4-hydroxyoxan-2-one Traditional Name: 6-[(E)-2-[6-cyclopropyl-3-ethyl-4-(4-fluorophenyl)-2-methyl-thieno[2,3-b]pyridin-5-yl]vinyl]-4-hydroxy-tetrahydropyran-2-one Formula: C26H26FNO3S MolecularWeight: 451.552943

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=NC(=C(C(=C12)C3=CC=C(C=C3)F)C=CC4CC(CC(=O)O4)O)C5CC5)C

Isomeric SMILES

CCC1=C(SC2=NC(=C(C(=C12)C3=CC=C(C=C3)F)/C=C/C4CC(CC(=O)O4)O)C5CC5)C

InChI

InChI=1S/C26H26FNO3S/c1-3-20-14(2)32-26-24(20)23(15-6-8-17(27)9-7-15)21(25(28-26)16-4-5-16)11-10-19-12-18(29)13-22(30)31-19/h6-11,16,18-19,29H,3-5,12-13H2,1-2H3/b11-10+