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

Systemtic Name: 2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[2-(p-tolyl)thiazol-4-yl]ethanone CAS Name: 2-[2-(4-methylphenyl)-4-thiazolyl]-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethanone Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[2-(p-tolyl)thiazol-4-yl]ethanone Formula: C23H26N3OS+ MolecularWeight: 392.53704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-18-7-9-20(10-8-18)23-24-21(17-28-23)15-22(27)26-13-11-25(12-14-26)16-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3/p+1