(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(thiophene-2-carbonylamino)benzoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(thiophene-2-carbonylamino)benzoate Traditional Name: 3-(2-thenoylamino)benzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C19H13N3O4S2 MolecularWeight: 411.45422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C19H13N3O4S2/c23-17(14-5-2-7-27-14)20-12-4-1-3-11(9-12)19(25)26-10-15-21-13-6-8-28-16(13)18(24)22-15/h1-9H,10H2,(H,20,23)(H,21,22,24)