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

Systemtic Name: 3-bromanyl-N5-phenethyl-N7-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: 3-bromo-N5-phenethyl-N7-(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: 3-bromo-N5-phenethyl-N7-(3-pyridinylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 3-bromo-5-N-phenethyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: [3-bromo-5-(phenethylamino)pyrazolo[1,5-a]pyrimidin-7-yl]-(3-pyridylmethyl)amine Formula: C20H19BrN6 MolecularWeight: 423.30906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br

InChI

InChI=1S/C20H19BrN6/c21-17-14-25-27-19(24-13-16-7-4-9-22-12-16)11-18(26-20(17)27)23-10-8-15-5-2-1-3-6-15/h1-7,9,11-12,14,24H,8,10,13H2,(H,23,26)