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

Systemtic Name: 3-bromanyl-N5-methyl-N5-phenethyl-N7-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: 3-bromo-N5-methyl-N5-phenethyl-N7-(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: 3-bromo-N5-methyl-N5-phenethyl-N7-(3-pyridinylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 3-bromo-5-N-methyl-5-N-phenethyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: [3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-methyl-phenethyl-amine Formula: C21H21BrN6 MolecularWeight: 437.33564

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

InChI

InChI=1S/C21H21BrN6/c1-27(11-9-16-6-3-2-4-7-16)20-12-19(24-14-17-8-5-10-23-13-17)28-21(26-20)18(22)15-25-28/h2-8,10,12-13,15,24H,9,11,14H2,1H3