4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazole

Systemtic Name: 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazole Openeye Name: 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)thiazole CAS Name: 4-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-(4-ethoxy-3-methoxyphenyl)thiazole IUPAC Name: 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole Traditional Name: 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)thiazole Formula: C23H27ClN3O4S2+ MolecularWeight: 509.06118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C23H26ClN3O4S2/c1-3-31-21-9-4-17(14-22(21)30-2)23-25-19(16-32-23)15-26-10-12-27(13-11-26)33(28,29)20-7-5-18(24)6-8-20/h4-9,14,16H,3,10-13,15H2,1-2H3/p+1