N-cyclopentyl-2-[2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopentyl-2-[2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[1-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]ethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide Formula: C23H32N4O2S+2 MolecularWeight: 428.59078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C23H30N4O2S/c28-22(17-27-13-11-26(12-14-27)16-19-8-5-15-30-19)25-21-10-4-3-9-20(21)23(29)24-18-6-1-2-7-18/h3-5,8-10,15,18H,1-2,6-7,11-14,16-17H2,(H,24,29)(H,25,28)/p+2