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

Systemtic Name: methyl 2-[(E)-2-(2,4-dimethylphenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(E)-2-(2,4-dimethylphenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(E)-2-(2,4-dimethylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(E)-2-(2,4-dimethylphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(E)-2-(2,4-dimethylphenyl)vinyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

InChI

InChI=1S/C19H18N2O3S/c1-10-5-6-13(11(2)9-10)7-8-14-20-17(22)15-12(3)16(19(23)24-4)25-18(15)21-14/h5-9H,1-4H3,(H,20,21,22)/b8-7+