2-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-1-methyl-pyrrol-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-1-methyl-pyrrol-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[4-(5-fluoro-2-hydroxy-benzoyl)-1-methyl-pyrrol-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-1-methyl-2-pyrrolyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[4-(5-fluoro-2-hydroxybenzoyl)-1-methylpyrrol-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[4-(5-fluoro-2-hydroxy-benzoyl)-1-methyl-pyrrol-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H12FN3O3S MolecularWeight: 369.369583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C2=NC3=C(C=CS3)C(=O)N2)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

CN1C=C(C=C1C2=NC3=C(C=CS3)C(=O)N2)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C18H12FN3O3S/c1-22-8-9(15(24)12-7-10(19)2-3-14(12)23)6-13(22)16-20-17(25)11-4-5-26-18(11)21-16/h2-8,23H,1H3,(H,20,21,25)