4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(2-methylphenyl)-1,3-thiazole

Systemtic Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(2-methylphenyl)-1,3-thiazole Openeye Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(o-tolyl)thiazole CAS Name: 4-[[4-(4-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-(2-methylphenyl)thiazole IUPAC Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(2-methylphenyl)-1,3-thiazole Traditional Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(o-tolyl)thiazole Formula: C22H26N3O3S2+ MolecularWeight: 444.59014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25N3O3S2/c1-17-5-3-4-6-21(17)22-23-18(16-29-22)15-24-11-13-25(14-12-24)30(26,27)20-9-7-19(28-2)8-10-20/h3-10,16H,11-15H2,1-2H3/p+1