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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-acetamidobenzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic 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-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C16H13N3O4S/c1-9(20)17-11-4-2-3-10(7-11)16(22)23-8-13-18-12-5-6-24-14(12)15(21)19-13/h2-7H,8H2,1H3,(H,17,20)(H,18,19,21)