4-(azepan-1-yl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(azepan-1-yl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(azepan-1-yl)-1-benzyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(1-azepanyl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-1-benzylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(azepan-1-yl)-1-benzyl-pyrazolo[3,4-d]pyrimidine Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=NC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=NC=NC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C18H21N5/c1-2-7-11-22(10-6-1)17-16-12-21-23(18(16)20-14-19-17)13-15-8-4-3-5-9-15/h3-5,8-9,12,14H,1-2,6-7,10-11,13H2