1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]-N-(4-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(pyridin-4-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[2-(3,5-dimethylanilino)-2-keto-ethyl]-N-(4-pyridylmethyl)isonipecotamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)NCC3=CC=NC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)NCC3=CC=NC=C3)C

InChI

InChI=1S/C22H28N4O2/c1-16-11-17(2)13-20(12-16)25-21(27)15-26-9-5-19(6-10-26)22(28)24-14-18-3-7-23-8-4-18/h3-4,7-8,11-13,19H,5-6,9-10,14-15H2,1-2H3,(H,24,28)(H,25,27)