N'-(3,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(3,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(3,5-dimethylphenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(3,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(3,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(3,5-dimethylphenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C22H28N4O2 MolecularWeight: 380.48332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=NC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=NC=C3)C

InChI

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