4-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)-2-(phenylsulfonyl)-1,3-thiazole

Systemtic Name: 4-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)-2-(phenylsulfonyl)-1,3-thiazole Openeye Name: 2-(benzenesulfonyl)-5-(4-methylpiperazin-4-ium-1-yl)-4-(p-tolylsulfonyl)thiazole CAS Name: 2-(benzenesulfonyl)-4-(4-methylphenyl)sulfonyl-5-(4-methyl-1-piperazin-4-iumyl)thiazole IUPAC Name: 2-(benzenesulfonyl)-4-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Traditional Name: 2-besyl-5-(4-methylpiperazin-4-ium-1-yl)-4-tosyl-thiazole Formula: C21H24N3O4S3+ MolecularWeight: 478.62796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=N2)S(=O)(=O)C3=CC=CC=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC(=N2)S(=O)(=O)C3=CC=CC=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H23N3O4S3/c1-16-8-10-18(11-9-16)30(25,26)19-20(24-14-12-23(2)13-15-24)29-21(22-19)31(27,28)17-6-4-3-5-7-17/h3-11H,12-15H2,1-2H3/p+1