4-methyl-3-[(1,3,6-trimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzoic acid

Systemtic Name: 4-methyl-3-[(1,3,6-trimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzoic acid Openeye Name: 4-methyl-3-[(1,3,6-trimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzoic acid CAS Name: 4-methyl-3-[(1,3,6-trimethyl-7-oxo-5-pyrazolo[4,3-d]pyrimidinyl)amino]benzoic acid IUPAC Name: 4-methyl-3-[(1,3,6-trimethyl-7-oxopyrazolo[4,3-d]pyrimidin-5-yl)amino]benzoic acid Traditional Name: 3-[(7-keto-1,3,6-trimethyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methyl-benzoic acid Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NC3=C(C(=O)N2C)N(N=C3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NC3=C(C(=O)N2C)N(N=C3C)C

InChI

InChI=1S/C16H17N5O3/c1-8-5-6-10(15(23)24)7-11(8)17-16-18-12-9(2)19-21(4)13(12)14(22)20(16)3/h5-7H,1-4H3,(H,17,18)(H,23,24)