N-[(4-methylphenyl)methyl]-N'-(2-piperidin-1-yl-2-thiophen-3-yl-ethyl)ethanediamide

Systemtic Name: N-[(4-methylphenyl)methyl]-N'-(2-piperidin-1-yl-2-thiophen-3-yl-ethyl)ethanediamide Openeye Name: N'-[2-(1-piperidyl)-2-(3-thienyl)ethyl]-N-(p-tolylmethyl)oxamide CAS Name: N-[(4-methylphenyl)methyl]-N'-[2-(1-piperidinyl)-2-(3-thiophenyl)ethyl]oxamide IUPAC Name: N-[(4-methylphenyl)methyl]-N'-(2-piperidin-1-yl-2-thiophen-3-ylethyl)oxamide Traditional Name: N-(4-methylbenzyl)-N'-[2-piperidino-2-(3-thienyl)ethyl]oxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(=O)NCC(C2=CSC=C2)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C(=O)NCC(C2=CSC=C2)N3CCCCC3

InChI

InChI=1S/C21H27N3O2S/c1-16-5-7-17(8-6-16)13-22-20(25)21(26)23-14-19(18-9-12-27-15-18)24-10-3-2-4-11-24/h5-9,12,15,19H,2-4,10-11,13-14H2,1H3,(H,22,25)(H,23,26)