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

Systemtic Name: 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Openeye Name: 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-thiazole CAS Name: 4-[[4-(3-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-phenylthiazole IUPAC Name: 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Traditional Name: 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-thiazole Formula: C20H21ClN3O2S2+ MolecularWeight: 434.98264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN3O2S2/c21-17-7-4-8-19(13-17)28(25,26)24-11-9-23(10-12-24)14-18-15-27-20(22-18)16-5-2-1-3-6-16/h1-8,13,15H,9-12,14H2/p+1