6-bromanyl-4-[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentyl]thieno[3,2-b]pyridin-7-one

Systemtic Name: 6-bromanyl-4-[4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentyl]thieno[3,2-b]pyridin-7-one Openeye Name: 6-bromo-4-[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-pentyl]thieno[3,2-b]pyridin-7-one CAS Name: 6-bromo-4-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentyl]-7-thieno[3,2-b]pyridinone IUPAC Name: 6-bromo-4-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentyl]thieno[3,2-b]pyridin-7-one Traditional Name: 6-bromo-4-[4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-pentyl]thieno[3,2-b]pyridin-7-one Formula: C20H21BrFNO3S MolecularWeight: 454.353043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CN1C=C(C(=O)C2=C1C=CS2)Br)O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(C)(CC(CN1C=C(C(=O)C2=C1C=CS2)Br)O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C20H21BrFNO3S/c1-20(2,14-8-12(22)4-5-17(14)26-3)9-13(24)10-23-11-15(21)18(25)19-16(23)6-7-27-19/h4-8,11,13,24H,9-10H2,1-3H3