N,N-diethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoylamino]benzamide Openeye Name: N,N-diethyl-3-[[2-[4-(2-thienylmethyl)piperazin-1-yl]acetyl]amino]benzamide CAS Name: N,N-diethyl-3-[[1-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetyl]amino]benzamide Traditional Name: N,N-diethyl-3-[[2-[4-(2-thenyl)piperazino]acetyl]amino]benzamide Formula: C22H30N4O2S MolecularWeight: 414.5642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C22H30N4O2S/c1-3-26(4-2)22(28)18-7-5-8-19(15-18)23-21(27)17-25-12-10-24(11-13-25)16-20-9-6-14-29-20/h5-9,14-15H,3-4,10-13,16-17H2,1-2H3,(H,23,27)