N-[4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide

Systemtic Name: N-[4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide Openeye Name: N-[4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]-N-phenyl-acetamide CAS Name: N-[4-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-2-thiazolyl]-N-phenylacetamide IUPAC Name: N-[4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-N-phenylacetamide Traditional Name: N-[4-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]-N-phenyl-acetamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H26N4O2S/c1-18(28)27(20-7-4-3-5-8-20)23-24-19(17-30-23)16-25-11-13-26(14-12-25)21-9-6-10-22(15-21)29-2/h3-10,15,17H,11-14,16H2,1-2H3/p+1