2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide

Systemtic Name: 2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide Openeye Name: 2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(o-tolyl)piperidine-1-carboxamide CAS Name: 2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)-1-piperidinecarboxamide IUPAC Name: 2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)piperidine-1-carboxamide Traditional Name: 2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(o-tolyl)piperidine-1-carboxamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)N2CCCCC2C3=NC(=NO3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N2CCCCC2C3=NC(=NO3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O2/c1-14-6-2-3-7-17(14)23-21(27)26-13-5-4-8-18(26)20-24-19(25-28-20)15-9-11-16(22)12-10-15/h2-3,6-7,9-12,18H,4-5,8,13H2,1H3,(H,23,27)