methyl 3-azanyl-5,7-dibutyl-4,6-bis(oxidanylidene)pyrazolo[3,4-d]pyrimidine-2-carboxylate

Systemtic Name: methyl 3-azanyl-5,7-dibutyl-4,6-bis(oxidanylidene)pyrazolo[3,4-d]pyrimidine-2-carboxylate Openeye Name: methyl 3-amino-5,7-dibutyl-4,6-dioxo-pyrazolo[3,4-d]pyrimidine-2-carboxylate CAS Name: 3-amino-5,7-dibutyl-4,6-dioxo-2-pyrazolo[3,4-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5,7-dibutyl-4,6-dioxopyrazolo[3,4-d]pyrimidine-2-carboxylate Traditional Name: 3-amino-5,7-dibutyl-4,6-diketo-pyrazolo[3,4-d]pyrimidine-2-carboxylic acid methyl ester Formula: C15H23N5O4 MolecularWeight: 337.37422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NN(C(=C2C(=O)N(C1=O)CCCC)N)C(=O)OC

Isomeric SMILES

CCCCN1C2=NN(C(=C2C(=O)N(C1=O)CCCC)N)C(=O)OC

InChI

InChI=1S/C15H23N5O4/c1-4-6-8-18-12-10(11(16)20(17-12)15(23)24-3)13(21)19(14(18)22)9-7-5-2/h4-9,16H2,1-3H3