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

Systemtic Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Openeye Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-thiazole CAS Name: 4-[[4-(4-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-phenylthiazole IUPAC Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-1,3-thiazole Traditional Name: 4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-phenyl-thiazole Formula: C21H24N3O3S2+ MolecularWeight: 430.56356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-27-19-7-9-20(10-8-19)29(25,26)24-13-11-23(12-14-24)15-18-16-28-21(22-18)17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3/p+1