2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(4,5-dimethylthiazol-3-ium-3-yl)ethanone CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(4,5-dimethylthiazol-3-ium-3-yl)ethanone Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H24N3OS/c1-15-16(2)23-14-21(15)13-18(22)20-10-8-19(9-11-20)12-17-6-4-3-5-7-17/h3-7,14H,8-13H2,1-2H3/q+1