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

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-1-(4-propylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]-1-(4-propylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-[2-(3,4-dimethoxyphenyl)-4-thiazolyl]-1-(4-propyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-1-(4-propylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]-1-(4-propylpiperazin-4-ium-1-yl)ethanone Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)CC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)CC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H27N3O3S/c1-4-7-22-8-10-23(11-9-22)19(24)13-16-14-27-20(21-16)15-5-6-17(25-2)18(12-15)26-3/h5-6,12,14H,4,7-11,13H2,1-3H3/p+1