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

Systemtic Name: 3-[2-ethyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[2-ethyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[2-ethyl-5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[2-ethyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[2-ethyl-4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C18H17N2O3S- MolecularWeight: 341.40418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N1CCC(=O)[O-]

Isomeric SMILES

CCC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N1CCC(=O)[O-]

InChI

InChI=1S/C18H18N2O3S/c1-3-14-19-17-16(18(23)20(14)9-8-15(21)22)13(10-24-17)12-6-4-11(2)5-7-12/h4-7,10H,3,8-9H2,1-2H3,(H,21,22)/p-1