N-(4-bromanyl-3-methyl-phenyl)-1-(2-chlorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(2-chlorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(2-chlorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-(2-chlorophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(2-chlorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(2-chlorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C22H22BrClN4O MolecularWeight: 473.79328

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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=C3Cl)C4CCNCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3Cl)C4CCNCC4)Br

InChI

InChI=1S/C22H22BrClN4O/c1-14-12-16(6-7-18(14)23)27-22(29)17-13-26-28(20-5-3-2-4-19(20)24)21(17)15-8-10-25-11-9-15/h2-7,12-13,15,25H,8-11H2,1H3,(H,27,29)