N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(2-chlorophenyl)thiazol-2-yl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: N-[4-(2-chlorophenyl)-2-thiazolyl]-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: N-[4-(2-chlorophenyl)thiazol-2-yl]-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C21H22ClN4O3S2+ MolecularWeight: 478.00738

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC(=CS3)C4=CC=CC=C4Cl

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC(=CS3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H21ClN4O3S2/c1-25-9-11-26(12-10-25)31(28,29)16-6-4-5-15(13-16)20(27)24-21-23-19(14-30-21)17-7-2-3-8-18(17)22/h2-8,13-14H,9-12H2,1H3,(H,23,24,27)/p+1