N-[4-[4-[[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidin-1-yl]carbonylphenyl]ethanamide

Systemtic Name: N-[4-[4-[[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidin-1-yl]carbonylphenyl]ethanamide Openeye Name: N-[4-[4-[[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidine-1-carbonyl]phenyl]acetamide CAS Name: N-[4-[[4-[[[3-bromo-5-(2-chlorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]amino]methyl]-1-piperidinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[4-[4-[[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidine-1-carbonyl]phenyl]acetamide Traditional Name: N-[4-[4-[[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidine-1-carbonyl]phenyl]acetamide Formula: C27H26BrClN6O2 MolecularWeight: 581.89134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCC(CC2)CNC3=CC(=NC4=C(C=NN34)Br)C5=CC=CC=C5Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCC(CC2)CNC3=CC(=NC4=C(C=NN34)Br)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H26BrClN6O2/c1-17(36)32-20-8-6-19(7-9-20)27(37)34-12-10-18(11-13-34)15-30-25-14-24(21-4-2-3-5-23(21)29)33-26-22(28)16-31-35(25)26/h2-9,14,16,18,30H,10-13,15H2,1H3,(H,32,36)