3-bromanyl-N5,N7-bis(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine

Systemtic Name: 3-bromanyl-N5,N7-bis(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: 3-bromo-N5,N7-bis(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: 3-bromo-N5,N7-bis(3-pyridinylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 3-bromo-5-N,7-N-bis(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: [3-bromo-5-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-7-yl]-(3-pyridylmethyl)amine Formula: C18H16BrN7 MolecularWeight: 410.27054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=CC(=NC3=C(C=NN23)Br)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CN=C1)CNC2=CC(=NC3=C(C=NN23)Br)NCC4=CN=CC=C4

InChI

InChI=1S/C18H16BrN7/c19-15-12-24-26-17(23-11-14-4-2-6-21-9-14)7-16(25-18(15)26)22-10-13-3-1-5-20-8-13/h1-9,12,23H,10-11H2,(H,22,25)