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

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)-2-(phenylsulfonyl)-1,3-thiazole Openeye Name: 2-(benzenesulfonyl)-4-(4-chlorophenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)thiazole CAS Name: 2-(benzenesulfonyl)-4-(4-chlorophenyl)sulfonyl-5-(4-methyl-1-piperazin-4-iumyl)thiazole IUPAC Name: 2-(benzenesulfonyl)-4-(4-chlorophenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole Traditional Name: 2-besyl-4-(4-chlorophenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)thiazole Formula: C20H21ClN3O4S3+ MolecularWeight: 499.04644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O4S3/c1-23-11-13-24(14-12-23)19-18(30(25,26)17-9-7-15(21)8-10-17)22-20(29-19)31(27,28)16-5-3-2-4-6-16/h2-10H,11-14H2,1H3/p+1