4-[2-(5-methyl-4-oxidanylidene-6-phenylmethoxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(5-methyl-4-oxidanylidene-6-phenylmethoxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(6-benzyloxycarbonyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoic acid CAS Name: 4-[[2-(5-methyl-4-oxo-6-phenylmethoxycarbonyl-3-thieno[2,3-d]pyrimidinyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(5-methyl-4-oxo-6-phenylmethoxycarbonylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(6-carbobenzoxy-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoic acid Formula: C24H19N3O6S MolecularWeight: 477.48916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=C(C=C3)C(=O)O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=C(C=C3)C(=O)O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H19N3O6S/c1-14-19-21(34-20(14)24(32)33-12-15-5-3-2-4-6-15)25-13-27(22(19)29)11-18(28)26-17-9-7-16(8-10-17)23(30)31/h2-10,13H,11-12H2,1H3,(H,26,28)(H,30,31)