N-(5-bromanylpyridin-2-yl)-1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]piperidine-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[2-keto-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]ethyl]nipecotamide Formula: C23H25BrN6O2 MolecularWeight: 497.3876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=NC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=NC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H25BrN6O2/c1-16-12-21(30(28-16)19-7-3-2-4-8-19)27-22(31)15-29-11-5-6-17(14-29)23(32)26-20-10-9-18(24)13-25-20/h2-4,7-10,12-13,17H,5-6,11,14-15H2,1H3,(H,27,31)(H,25,26,32)