ethyl 2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-2,4-bis(oxidanylidene)-6-phenyl-thieno[2,3-d]pyrimidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-2,4-bis(oxidanylidene)-6-phenyl-thieno[2,3-d]pyrimidin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(4-bromo-2-fluoro-phenyl)methyl]-2,4-dioxo-6-phenyl-thieno[2,3-d]pyrimidin-1-yl]acetate CAS Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-2,4-dioxo-6-phenyl-1-thieno[2,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-bromo-2-fluorophenyl)methyl]-2,4-dioxo-6-phenylthieno[2,3-d]pyrimidin-1-yl]acetate Traditional Name: 2-[3-(4-bromo-2-fluoro-benzyl)-2,4-diketo-6-phenyl-thieno[2,3-d]pyrimidin-1-yl]acetic acid ethyl ester Formula: C23H18BrFN2O4S MolecularWeight: 517.367423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(S2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(S2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C23H18BrFN2O4S/c1-2-31-20(28)13-27-22-17(11-19(32-22)14-6-4-3-5-7-14)21(29)26(23(27)30)12-15-8-9-16(24)10-18(15)25/h3-11H,2,12-13H2,1H3