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

Systemtic Name: ethyl 2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-6-chloranyl-4-oxidanylidene-2-sulfanylidene-thieno[2,3-d]pyrimidin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(4-bromo-2-fluoro-phenyl)methyl]-6-chloro-4-oxo-2-thioxo-thieno[2,3-d]pyrimidin-1-yl]acetate CAS Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-6-chloro-4-oxo-2-sulfanylidene-1-thieno[2,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-bromo-2-fluorophenyl)methyl]-6-chloro-4-oxo-2-sulfanylidenethieno[2,3-d]pyrimidin-1-yl]acetate Traditional Name: 2-[3-(4-bromo-2-fluoro-benzyl)-6-chloro-4-keto-2-thioxo-thieno[2,3-d]pyrimidin-1-yl]acetic acid ethyl ester Formula: C17H13BrClFN2O3S2 MolecularWeight: 491.782123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(S2)Cl)C(=O)N(C1=S)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(S2)Cl)C(=O)N(C1=S)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H13BrClFN2O3S2/c1-2-25-14(23)8-22-16-11(6-13(19)27-16)15(24)21(17(22)26)7-9-3-4-10(18)5-12(9)20/h3-6H,2,7-8H2,1H3