N-(propan-2-ylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(propan-2-ylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(isopropylcarbamoyl)-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[oxo-(propan-2-ylamino)methyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(propan-2-ylcarbamoyl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(isopropylcarbamoyl)-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]acetamide Formula: C15H26N4O2S+2 MolecularWeight: 326.45754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CS2

Isomeric SMILES

CC(C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CS2

InChI

InChI=1S/C15H24N4O2S/c1-12(2)16-15(21)17-14(20)11-19-7-5-18(6-8-19)10-13-4-3-9-22-13/h3-4,9,12H,5-8,10-11H2,1-2H3,(H2,16,17,20,21)/p+2