2-methylpropyl 2-[5-(4-ethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 2-methylpropyl 2-[5-(4-ethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: isobutyl 2-[5-(4-ethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[5-(4-ethoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-(4-keto-5-p-phenetyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid isobutyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C(C)C(=O)OCC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C(C)C(=O)OCC(C)C

InChI

InChI=1S/C21H24N2O4S/c1-5-26-16-8-6-15(7-9-16)17-11-28-19-18(17)20(24)23(12-22-19)14(4)21(25)27-10-13(2)3/h6-9,11-14H,5,10H2,1-4H3