1-[4-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[[2-(2,3-dimethoxyphenyl)-4-thiazolyl]methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Formula: C18H24N3O3S+ MolecularWeight: 362.46646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=CSC(=N2)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C18H23N3O3S/c1-13(22)21-9-7-20(8-10-21)11-14-12-25-18(19-14)15-5-4-6-16(23-2)17(15)24-3/h4-6,12H,7-11H2,1-3H3/p+1