N'-(2,6-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(2,6-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(2,6-dimethylphenyl)-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(2,6-dimethylphenyl)-N-[[1-(3-pyridinylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(2,6-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(2,6-dimethylphenyl)-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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