3-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione

Systemtic Name: 3-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione Openeye Name: 3-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]oxazolidine-2-thione CAS Name: 3-[[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-oxazolidinethione IUPAC Name: 3-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione Traditional Name: 3-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]oxazolidine-2-thione Formula: C16H24N3O5S2+ MolecularWeight: 402.50886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC[NH+](CC2)CN3CCOC3=S

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC[NH+](CC2)CN3CCOC3=S

InChI

InChI=1S/C16H23N3O5S2/c1-22-13-3-4-14(23-2)15(11-13)26(20,21)19-7-5-17(6-8-19)12-18-9-10-24-16(18)25/h3-4,11H,5-10,12H2,1-2H3/p+1