ethyl 3,5-dimethyl-4-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxoethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN2C=NC3=C(C2=O)C=NN3C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN2C=NC3=C(C2=O)C=NN3C)C

InChI

InChI=1S/C17H19N5O4/c1-5-26-17(25)14-9(2)13(10(3)20-14)12(23)7-22-8-18-15-11(16(22)24)6-19-21(15)4/h6,8,20H,5,7H2,1-4H3