(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(furan-2-carbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4,5-dimethoxybenzoic 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 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(2-furoylamino)-4,5-dimethoxy-benzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C21H17N3O7S MolecularWeight: 455.44058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)NC(=O)C4=CC=CO4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)NC(=O)C4=CC=CO4)OC

InChI

InChI=1S/C21H17N3O7S/c1-28-15-8-11(13(9-16(15)29-2)23-19(25)14-4-3-6-30-14)21(27)31-10-17-22-12-5-7-32-18(12)20(26)24-17/h3-9H,10H2,1-2H3,(H,23,25)(H,22,24,26)