2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazine-1,4-diiumyl]-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-isopropyl-acetamide Formula: C16H27ClN4O2S+2 MolecularWeight: 374.92918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(S2)Cl

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(S2)Cl

InChI

InChI=1S/C16H25ClN4O2S/c1-12(2)19-15(22)9-18-16(23)11-21-7-5-20(6-8-21)10-13-3-4-14(17)24-13/h3-4,12H,5-11H2,1-2H3,(H,18,23)(H,19,22)/p+2