3-[(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methyl-benzoate

Systemtic Name: 3-[(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methyl-benzoate Openeye Name: 3-[(1,3-dimethyl-7-oxo-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methyl-benzoate CAS Name: 3-[(1,3-dimethyl-7-oxo-6-propyl-5-pyrazolo[4,3-d]pyrimidinyl)amino]-4-methylbenzoate IUPAC Name: 3-[(1,3-dimethyl-7-oxo-6-propylpyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methylbenzoate Traditional Name: 3-[(7-keto-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]-4-methyl-benzoate Formula: C18H20N5O3- MolecularWeight: 354.3831

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1NC3=C(C=CC(=C3)C(=O)[O-])C

Isomeric SMILES

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1NC3=C(C=CC(=C3)C(=O)[O-])C

InChI

InChI=1S/C18H21N5O3/c1-5-8-23-16(24)15-14(11(3)21-22(15)4)20-18(23)19-13-9-12(17(25)26)7-6-10(13)2/h6-7,9H,5,8H2,1-4H3,(H,19,20)(H,25,26)/p-1