2-[6-methyl-4-oxidanylidene-2-[(1,5,6-trimethylbenzimidazol-2-yl)amino]-1H-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-4-oxidanylidene-2-[(1,5,6-trimethylbenzimidazol-2-yl)amino]-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[6-methyl-4-oxo-2-[(1,5,6-trimethylbenzimidazol-2-yl)amino]-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[6-methyl-4-oxo-2-[(1,5,6-trimethyl-2-benzimidazolyl)amino]-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[6-methyl-4-oxo-2-[(1,5,6-trimethylbenzimidazol-2-yl)amino]-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[4-keto-6-methyl-2-[(1,5,6-trimethylbenzimidazol-2-yl)amino]-1H-pyrimidin-5-yl]acetic acid Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)NC3=NC(=O)C(=C(N3)C)CC(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)NC3=NC(=O)C(=C(N3)C)CC(=O)O)C

InChI

InChI=1S/C17H19N5O3/c1-8-5-12-13(6-9(8)2)22(4)17(19-12)21-16-18-10(3)11(7-14(23)24)15(25)20-16/h5-6H,7H2,1-4H3,(H,23,24)(H2,18,19,20,21,25)