N5-(4-azanylcyclohexyl)-3-bromanyl-N7-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine

Systemtic Name: N5-(4-azanylcyclohexyl)-3-bromanyl-N7-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: N5-(4-aminocyclohexyl)-3-bromo-N7-(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: N5-(4-aminocyclohexyl)-3-bromo-N7-(3-pyridinylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 5-N-(4-aminocyclohexyl)-3-bromo-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: (4-aminocyclohexyl)-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amine Formula: C18H22BrN7 MolecularWeight: 416.31818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

Isomeric SMILES

C1CC(CCC1N)NC2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

InChI

InChI=1S/C18H22BrN7/c19-15-11-23-26-17(22-10-12-2-1-7-21-9-12)8-16(25-18(15)26)24-14-5-3-13(20)4-6-14/h1-2,7-9,11,13-14,22H,3-6,10,20H2,(H,24,25)