N-phenyl-N-[4-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-phenyl-N-[4-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-phenyl-N-[4-[[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]methyl]thiazol-2-yl]acetamide CAS Name: N-phenyl-N-[4-[[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]-2-thiazolyl]acetamide IUPAC Name: N-phenyl-N-[4-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-phenyl-N-[4-[[4-(2-thenyl)piperazine-1,4-diium-1-yl]methyl]thiazol-2-yl]acetamide Formula: C21H26N4OS2+2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C21H24N4OS2/c1-17(26)25(19-6-3-2-4-7-19)21-22-18(16-28-21)14-23-9-11-24(12-10-23)15-20-8-5-13-27-20/h2-8,13,16H,9-12,14-15H2,1H3/p+2