N-cyclohexyl-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-cyclohexyl-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Openeye Name: N-cyclohexyl-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide CAS Name: N-cyclohexyl-4-(1-phenyl-6-propyl-4-pyrazolo[3,4-d]pyrimidinyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-cyclohexyl-4-(1-phenyl-6-propylpyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Traditional Name: N-cyclohexyl-4-(1-phenyl-6-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Formula: C26H35N7O MolecularWeight: 461.6024

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCCN(CC4)C(=O)NC5CCCCC5

Isomeric SMILES

CCCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)N4CCCN(CC4)C(=O)NC5CCCCC5

InChI

InChI=1S/C26H35N7O/c1-2-10-23-29-24(22-19-27-33(25(22)30-23)21-13-7-4-8-14-21)31-15-9-16-32(18-17-31)26(34)28-20-11-5-3-6-12-20/h4,7-8,13-14,19-20H,2-3,5-6,9-12,15-18H2,1H3,(H,28,34)