ethyl 5-methyl-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-[(E)-2-(4-methylsulfanylphenyl)vinyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[(E)-2-[4-(methylthio)phenyl]ethenyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(E)-2-[4-(methylthio)phenyl]vinyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C=CC3=CC=C(C=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)/C=C/C3=CC=C(C=C3)SC)C

InChI

InChI=1S/C19H18N2O3S2/c1-4-24-19(23)16-11(2)15-17(22)20-14(21-18(15)26-16)10-7-12-5-8-13(25-3)9-6-12/h5-10H,4H2,1-3H3,(H,20,21,22)/b10-7+