5-(2-ethylhexanoylamino)-2-(4-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-(2-ethylhexanoylamino)-2-(4-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-(2-ethylhexanoylamino)-2-(4-methyl-1-piperidyl)-N-(3-pyridylmethyl)benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-2-(4-methyl-1-piperidinyl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-(2-ethylhexanoylamino)-2-(4-methylpiperidin-1-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-(2-ethylhexanoylamino)-2-(4-methylpiperidino)-N-(3-pyridylmethyl)benzamide Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCC(CC2)C)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCC(CC2)C)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C27H38N4O2/c1-4-6-9-22(5-2)26(32)30-23-10-11-25(31-15-12-20(3)13-16-31)24(17-23)27(33)29-19-21-8-7-14-28-18-21/h7-8,10-11,14,17-18,20,22H,4-6,9,12-13,15-16,19H2,1-3H3,(H,29,33)(H,30,32)