[4-(methylcarbamoyl)phenyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: [4-(methylcarbamoyl)phenyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: [4-(methylcarbamoyl)phenyl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid [4-(methylcarbamoyl)phenyl] ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C17H15N3O4S/c1-18-15(22)11-2-4-12(5-3-11)24-14(21)6-8-20-10-19-16-13(17(20)23)7-9-25-16/h2-5,7,9-10H,6,8H2,1H3,(H,18,22)