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

Systemtic Name: N'-(3-nitrophenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(3-nitrophenyl)-N-[[1-(2-thienylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(3-nitrophenyl)-N-[[1-(thiophen-2-ylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(3-nitrophenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(3-nitrophenyl)-N-[[1-(2-thenyl)-4-piperidyl]methyl]oxamide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CS3

Isomeric SMILES

C1CN(CCC1CNC(=O)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CS3

InChI

InChI=1S/C19H22N4O4S/c24-18(19(25)21-15-3-1-4-16(11-15)23(26)27)20-12-14-6-8-22(9-7-14)13-17-5-2-10-28-17/h1-5,10-11,14H,6-9,12-13H2,(H,20,24)(H,21,25)