N-(4-bromophenyl)-1-(3-chloranyl-2-methyl-phenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-1-(3-chloranyl-2-methyl-phenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-1-(3-chloro-2-methyl-phenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(4-bromophenyl)-1-(3-chloro-2-methylphenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-bromophenyl)-1-(3-chloro-2-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-1-(3-chloro-2-methyl-phenyl)-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=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)Br)C4CCNCC4

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)Br)C4CCNCC4

InChI

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