N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)thiazol-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)-2-thiazolyl]methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[[4-(4-methoxyphenyl)thiazol-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C21H32N4O2S+2 MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=NC(=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=NC(=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H30N4O2S/c1-21(2,3)23-19(26)13-24-9-11-25(12-10-24)14-20-22-18(15-28-20)16-5-7-17(27-4)8-6-16/h5-8,15H,9-14H2,1-4H3,(H,23,26)/p+2