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

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-2-(phenylsulfonyl)-1,3-thiazole Openeye Name: 2-(benzenesulfonyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(p-tolylsulfonyl)thiazole CAS Name: 2-(benzenesulfonyl)-5-(4-ethyl-1-piperazin-4-iumyl)-4-(4-methylphenyl)sulfonylthiazole IUPAC Name: 2-(benzenesulfonyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-1,3-thiazole Traditional Name: 2-besyl-5-(4-ethylpiperazin-4-ium-1-yl)-4-tosyl-thiazole Formula: C22H26N3O4S3+ MolecularWeight: 492.65454

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(N=C(S2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(N=C(S2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H25N3O4S3/c1-3-24-13-15-25(16-14-24)21-20(31(26,27)19-11-9-17(2)10-12-19)23-22(30-21)32(28,29)18-7-5-4-6-8-18/h4-12H,3,13-16H2,1-2H3/p+1