N-(5-bromanylpyridin-2-yl)-1-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]carbonyl-piperidine-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[5-methyl-1-(m-tolyl)pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[[5-methyl-1-(3-methylphenyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[5-methyl-1-(3-methylphenyl)pyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[5-methyl-1-(m-tolyl)pyrazole-4-carbonyl]nipecotamide Formula: C23H24BrN5O2 MolecularWeight: 482.37296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)N3CCCC(C3)C(=O)NC4=NC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)N3CCCC(C3)C(=O)NC4=NC=C(C=C4)Br)C

InChI

InChI=1S/C23H24BrN5O2/c1-15-5-3-7-19(11-15)29-16(2)20(13-26-29)23(31)28-10-4-6-17(14-28)22(30)27-21-9-8-18(24)12-25-21/h3,5,7-9,11-13,17H,4,6,10,14H2,1-2H3,(H,25,27,30)