N'-(3-chloranyl-4-methyl-phenyl)-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(3-chloranyl-4-methyl-phenyl)-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(3-chloro-4-methyl-phenyl)-N-[[1-(2-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(3-chloro-4-methylphenyl)-N-[[1-(2-pyridinylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(3-chloro-4-methylphenyl)-N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(3-chloro-4-methyl-phenyl)-N-[[1-(2-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C21H25ClN4O2 MolecularWeight: 400.9018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CC=N3)Cl

InChI

InChI=1S/C21H25ClN4O2/c1-15-5-6-17(12-19(15)22)25-21(28)20(27)24-13-16-7-10-26(11-8-16)14-18-4-2-3-9-23-18/h2-6,9,12,16H,7-8,10-11,13-14H2,1H3,(H,24,27)(H,25,28)