N-[(2-azanylpyrimidin-5-yl)methyl]-3-bromanyl-5-piperidin-3-yl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: N-[(2-azanylpyrimidin-5-yl)methyl]-3-bromanyl-5-piperidin-3-yl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: N-[(2-aminopyrimidin-5-yl)methyl]-3-bromo-5-(3-piperidyl)pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: N-[(2-amino-5-pyrimidinyl)methyl]-3-bromo-5-(3-piperidinyl)-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: N-[(2-aminopyrimidin-5-yl)methyl]-3-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (2-aminopyrimidin-5-yl)methyl-[3-bromo-5-(3-piperidyl)pyrazolo[1,5-a]pyrimidin-7-yl]amine Formula: C16H19BrN8 MolecularWeight: 403.27966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=C(N=C4)N)Br

Isomeric SMILES

C1CC(CNC1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=C(N=C4)N)Br

InChI

InChI=1S/C16H19BrN8/c17-12-9-23-25-14(20-5-10-6-21-16(18)22-7-10)4-13(24-15(12)25)11-2-1-3-19-8-11/h4,6-7,9,11,19-20H,1-3,5,8H2,(H2,18,21,22)