N-[(2,5-dimethylphenyl)methyl]-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: N-[(2,5-dimethylphenyl)methyl]-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide Openeye Name: N-[(2,5-dimethylphenyl)methyl]-4-(pyridine-3-carbonyl)piperazine-2-carboxamide CAS Name: N-[(2,5-dimethylphenyl)methyl]-4-[oxo(3-pyridinyl)methyl]-2-piperazinecarboxamide IUPAC Name: N-[(2,5-dimethylphenyl)methyl]-4-(pyridine-3-carbonyl)piperazine-2-carboxamide Traditional Name: N-(2,5-dimethylbenzyl)-4-nicotinoyl-piperazine-2-carboxamide Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C2CN(CCN2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C2CN(CCN2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H24N4O2/c1-14-5-6-15(2)17(10-14)12-23-19(25)18-13-24(9-8-22-18)20(26)16-4-3-7-21-11-16/h3-7,10-11,18,22H,8-9,12-13H2,1-2H3,(H,23,25)