3-(7-azanyl-6-bromanyl-5-piperidin-3-yl-pyrazolo[1,5-a]pyrimidin-3-yl)benzamide

Systemtic Name: 3-(7-azanyl-6-bromanyl-5-piperidin-3-yl-pyrazolo[1,5-a]pyrimidin-3-yl)benzamide Openeye Name: 3-[7-amino-6-bromo-5-(3-piperidyl)pyrazolo[1,5-a]pyrimidin-3-yl]benzamide CAS Name: 3-[7-amino-6-bromo-5-(3-piperidinyl)-3-pyrazolo[1,5-a]pyrimidinyl]benzamide IUPAC Name: 3-(7-amino-6-bromo-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl)benzamide Traditional Name: 3-[7-amino-6-bromo-5-(3-piperidyl)pyrazolo[1,5-a]pyrimidin-3-yl]benzamide Formula: C18H19BrN6O MolecularWeight: 415.28706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=NC3=C(C=NN3C(=C2Br)N)C4=CC(=CC=C4)C(=O)N

Isomeric SMILES

C1CC(CNC1)C2=NC3=C(C=NN3C(=C2Br)N)C4=CC(=CC=C4)C(=O)N

InChI

InChI=1S/C18H19BrN6O/c19-14-15(12-5-2-6-22-8-12)24-18-13(9-23-25(18)16(14)20)10-3-1-4-11(7-10)17(21)26/h1,3-4,7,9,12,22H,2,5-6,8,20H2,(H2,21,26)