N-(3-methylphenyl)-1-(2-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-methylphenyl)-1-(2-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-3-carboxamide Openeye Name: N-(m-tolyl)-1-(2-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-3-carboxamide CAS Name: N-(3-methylphenyl)-1-(2-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(3-methylphenyl)-1-(2-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperidine-3-carboxamide Traditional Name: N-(m-tolyl)-1-(2-phenylpyrazolo[3,4-d]pyrimidin-4-yl)nipecotamide Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2CCCN(C2)C3=NC=NC4=NN(C=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2CCCN(C2)C3=NC=NC4=NN(C=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H24N6O/c1-17-7-5-9-19(13-17)27-24(31)18-8-6-12-29(14-18)23-21-15-30(20-10-3-2-4-11-20)28-22(21)25-16-26-23/h2-5,7,9-11,13,15-16,18H,6,8,12,14H2,1H3,(H,27,31)