4-butyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]cyclohexanecarboxamide CAS Name: 4-butyl-N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]cyclohexanecarboxamide Formula: C26H31N7O MolecularWeight: 457.57064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC(=NN2C3=NC=NC4=C3C=NN4C5=CC=CC=C5)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC(=NN2C3=NC=NC4=C3C=NN4C5=CC=CC=C5)C

InChI

InChI=1S/C26H31N7O/c1-3-4-8-19-11-13-20(14-12-19)26(34)30-23-15-18(2)31-33(23)25-22-16-29-32(24(22)27-17-28-25)21-9-6-5-7-10-21/h5-7,9-10,15-17,19-20H,3-4,8,11-14H2,1-2H3,(H,30,34)