N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)methyl]phenyl]cyclopropanecarboxamide Formula: C16H16N6O MolecularWeight: 308.33784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC3=NC=NC4=C3C=NN4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C16H16N6O/c23-16(11-4-5-11)21-12-3-1-2-10(6-12)7-17-14-13-8-20-22-15(13)19-9-18-14/h1-3,6,8-9,11H,4-5,7H2,(H,21,23)(H2,17,18,19,20,22)