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

Systemtic Name: methyl 2-[(E)-2-(4-methoxy-3-propoxy-phenyl)ethenyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(E)-2-(4-methoxy-3-propoxy-phenyl)vinyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(E)-2-(4-methoxy-3-propoxyphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(E)-2-(4-methoxy-3-propoxyphenyl)ethenyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2-[(E)-2-(4-methoxy-3-propoxy-phenyl)vinyl]-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C=CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)/C=C/C2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)OC

InChI

InChI=1S/C21H22N2O5S/c1-5-10-28-15-11-13(6-8-14(15)26-3)7-9-16-22-19(24)17-12(2)18(21(25)27-4)29-20(17)23-16/h6-9,11H,5,10H2,1-4H3,(H,22,23,24)/b9-7+