N-(4-bromanyl-3-methyl-phenyl)-1-phenyl-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-phenyl-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-phenyl-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-phenyl-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-phenyl-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C22H23BrN4O MolecularWeight: 439.34822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCNCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCNCC4)Br

InChI

InChI=1S/C22H23BrN4O/c1-15-13-17(7-8-20(15)23)26-22(28)19-14-25-27(18-5-3-2-4-6-18)21(19)16-9-11-24-12-10-16/h2-8,13-14,16,24H,9-12H2,1H3,(H,26,28)