ethyl 2,5-dimethyl-4-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[1-oxo-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN2C=NC3=C(C2=O)C=CS3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN2C=NC3=C(C2=O)C=CS3)C)C

InChI

InChI=1S/C17H17N3O4S/c1-4-24-17(23)14-10(3)19-9(2)13(14)12(21)7-20-8-18-15-11(16(20)22)5-6-25-15/h5-6,8,19H,4,7H2,1-3H3