N-(4-methylphenyl)-4-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methylphenyl)-4-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-amine Openeye Name: N-(p-tolyl)-4-[[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]methyl]thiazol-2-amine CAS Name: N-(4-methylphenyl)-4-[[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazin-1-iumyl]methyl]-2-thiazolamine IUPAC Name: N-(4-methylphenyl)-4-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-amine Traditional Name: p-tolyl-[4-[[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]methyl]thiazol-2-yl]amine Formula: C23H27N4O2S2+ MolecularWeight: 455.61608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S2/c1-19-7-9-21(10-8-19)24-23-25-22(18-30-23)17-26-12-14-27(15-13-26)31(28,29)16-11-20-5-3-2-4-6-20/h2-11,16,18H,12-15,17H2,1H3,(H,24,25)/p+1/b16-11+