4-[[cyclopropyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[cyclopropyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[cyclopropyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[cyclopropyl-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[cyclopropyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[cyclopropyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]methyl]-N-methyl-benzamide Formula: C23H22N6O MolecularWeight: 398.46038

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C2CC2)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C2CC2)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H22N6O/c1-24-23(30)17-9-7-16(8-10-17)14-28(18-11-12-18)21-20-13-27-29(22(20)26-15-25-21)19-5-3-2-4-6-19/h2-10,13,15,18H,11-12,14H2,1H3,(H,24,30)