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

Systemtic Name: 3-bromanyl-N5-(3-methylbutyl)-N7-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: 3-bromo-N5-isopentyl-N7-(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: 3-bromo-N5-(3-methylbutyl)-N7-(3-pyridinylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 3-bromo-5-N-(3-methylbutyl)-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: [3-bromo-5-(isoamylamino)pyrazolo[1,5-a]pyrimidin-7-yl]-(3-pyridylmethyl)amine Formula: C17H21BrN6 MolecularWeight: 389.29284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC2=C(C=NN2C(=C1)NCC3=CN=CC=C3)Br

Isomeric SMILES

CC(C)CCNC1=NC2=C(C=NN2C(=C1)NCC3=CN=CC=C3)Br

InChI

InChI=1S/C17H21BrN6/c1-12(2)5-7-20-15-8-16(21-10-13-4-3-6-19-9-13)24-17(23-15)14(18)11-22-24/h3-4,6,8-9,11-12,21H,5,7,10H2,1-2H3,(H,20,23)