2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopentyl-benzamide

Systemtic Name: 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopentyl-benzamide Openeye Name: 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentyl-benzamide CAS Name: 2-[[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-cyclopentylbenzamide IUPAC Name: 2-[[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentylbenzamide Traditional Name: 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentyl-benzamide Formula: C23H30ClN4O2S+ MolecularWeight: 462.0279

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C23H29ClN4O2S/c24-21-10-9-18(31-21)15-27-11-13-28(14-12-27)16-22(29)26-20-8-4-3-7-19(20)23(30)25-17-5-1-2-6-17/h3-4,7-10,17H,1-2,5-6,11-16H2,(H,25,30)(H,26,29)/p+1