4-(4-azanyl-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4-azanyl-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(4-amino-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(4-amino-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4-amino-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-amino-1-tert-butyl-2H-pyrazolo[3,4-d]pyrimidin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C15H17N5O MolecularWeight: 283.32838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=C3C=CC(=O)C=C3)N1)C(=NC=N2)N

Isomeric SMILES

CC(C)(C)N1C2=C(C(=C3C=CC(=O)C=C3)N1)C(=NC=N2)N

InChI

InChI=1S/C15H17N5O/c1-15(2,3)20-14-11(13(16)17-8-18-14)12(19-20)9-4-6-10(21)7-5-9/h4-8,19H,1-3H3,(H2,16,17,18)