ethyl 3-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C21H17N3O4S2/c1-2-28-21(27)18-15(10-16(30-18)13-6-4-3-5-7-13)23-17(25)11-24-12-22-19-14(20(24)26)8-9-29-19/h3-10,12H,2,11H2,1H3,(H,23,25)