4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide

Systemtic Name: 4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide Openeye Name: 4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide CAS Name: 4-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]-1-piperidinecarboxamide IUPAC Name: 4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide Traditional Name: 4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide Formula: C18H20BrN7O MolecularWeight: 430.3017

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br)C(=O)N

Isomeric SMILES

C1CN(CCC1C2=NC3=C(C=NN3C(=C2)NCC4=CN=CC=C4)Br)C(=O)N

InChI

InChI=1S/C18H20BrN7O/c19-14-11-23-26-16(22-10-12-2-1-5-21-9-12)8-15(24-17(14)26)13-3-6-25(7-4-13)18(20)27/h1-2,5,8-9,11,13,22H,3-4,6-7,10H2,(H2,20,27)