1-[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[6-(3-bromophenyl)-2-methyl-pyridine-3-carbonyl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[[6-(3-bromophenyl)-2-methyl-3-pyridinyl]-oxomethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[6-(3-bromophenyl)-2-methylpyridine-3-carbonyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[6-(3-bromophenyl)-2-methyl-nicotinoyl]-N-(3-pyridylmethyl)isonipecotamide Formula: C25H25BrN4O2 MolecularWeight: 493.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C25H25BrN4O2/c1-17-22(7-8-23(29-17)20-5-2-6-21(26)14-20)25(32)30-12-9-19(10-13-30)24(31)28-16-18-4-3-11-27-15-18/h2-8,11,14-15,19H,9-10,12-13,16H2,1H3,(H,28,31)