4-[[4-methyl-5-oxidanylidene-2-[(phenylmethyl)carbamoyl]-7H-[1,3]oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-methyl-5-oxidanylidene-2-[(phenylmethyl)carbamoyl]-7H-[1,3]oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid Openeye Name: 4-[[2-(benzylcarbamoyl)-4-methyl-5-oxo-7H-oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid CAS Name: 4-[[4-methyl-5-oxo-2-[oxo-[(phenylmethyl)amino]methyl]-7H-oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid IUPAC Name: 4-[[2-(benzylcarbamoyl)-4-methyl-5-oxo-7H-[1,3]oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid Traditional Name: 4-[[2-(benzylcarbamoyl)-5-keto-4-methyl-7H-oxazolo[4,5-d]pyrimidin-6-yl]methyl]benzoic acid Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)C(=O)O)OC(=N2)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)C(=O)O)OC(=N2)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O5/c1-25-18-17(31-20(24-18)19(27)23-11-14-5-3-2-4-6-14)13-26(22(25)30)12-15-7-9-16(10-8-15)21(28)29/h2-10H,11-13H2,1H3,(H,23,27)(H,28,29)