[5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]-(1-piperidyl)methanone CAS Name: [5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methyl-3-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methylpyrazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]-piperidino-methanone Formula: C22H20BrCl2N3O MolecularWeight: 493.2237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)N2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N(N=C1C(=O)N2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H20BrCl2N3O/c1-14-20(22(29)27-11-3-2-4-12-27)26-28(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3