ethyl 2-[6-bromanyl-5-methyl-1-[(2-methylsulfanylphenyl)methyl]-2,4-bis(oxidanylidene)thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-bromanyl-5-methyl-1-[(2-methylsulfanylphenyl)methyl]-2,4-bis(oxidanylidene)thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: ethyl 2-[6-bromo-5-methyl-1-[(2-methylsulfanylphenyl)methyl]-2,4-dioxo-thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[6-bromo-5-methyl-1-[[2-(methylthio)phenyl]methyl]-2,4-dioxo-3-thieno[2,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-bromo-5-methyl-1-[(2-methylsulfanylphenyl)methyl]-2,4-dioxothieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[6-bromo-2,4-diketo-5-methyl-1-[2-(methylthio)benzyl]thieno[2,3-d]pyrimidin-3-yl]acetic acid ethyl ester Formula: C19H19BrN2O4S2 MolecularWeight: 483.39916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=C(N(C1=O)CC3=CC=CC=C3SC)SC(=C2C)Br

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=C(N(C1=O)CC3=CC=CC=C3SC)SC(=C2C)Br

InChI

InChI=1S/C19H19BrN2O4S2/c1-4-26-14(23)10-21-17(24)15-11(2)16(20)28-18(15)22(19(21)25)9-12-7-5-6-8-13(12)27-3/h5-8H,4,9-10H2,1-3H3