1-(4-bromophenyl)carbonyl-N-(2,5-dimethylpyrazol-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(2,5-dimethylpyrazol-3-yl)piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(2,5-dimethylpyrazol-3-yl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(2,5-dimethyl-3-pyrazolyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(2,5-dimethylpyrazol-3-yl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-(2,5-dimethylpyrazol-3-yl)isonipecotamide Formula: C18H21BrN4O2 MolecularWeight: 405.28894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C18H21BrN4O2/c1-12-11-16(22(2)21-12)20-17(24)13-7-9-23(10-8-13)18(25)14-3-5-15(19)6-4-14/h3-6,11,13H,7-10H2,1-2H3,(H,20,24)