3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-N-(4-ethoxyphenyl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine

Systemtic Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-N-(4-ethoxyphenyl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine Openeye Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-N-(4-ethoxyphenyl)-1-methyl-3-oxido-imidazolidin-3-ium-4-amine CAS Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-N-(4-ethoxyphenyl)-1-methyl-3-oxido-4-imidazolidin-3-iumamine IUPAC Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-N-(4-ethoxyphenyl)-1-methyl-3-oxidoimidazolidin-3-ium-4-amine Traditional Name: [3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]-p-phenetyl-amine Formula: C18H27N5O4S2 MolecularWeight: 441.56808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=NN=C(S1)[N+]2(CN(CC2NC3=CC=C(C=C3)OCC)C)[O-]

Isomeric SMILES

CCCCS(=O)(=O)C1=NN=C(S1)[N+]2(CN(CC2NC3=CC=C(C=C3)OCC)C)[O-]

InChI

InChI=1S/C18H27N5O4S2/c1-4-6-11-29(25,26)18-21-20-17(28-18)23(24)13-22(3)12-16(23)19-14-7-9-15(10-8-14)27-5-2/h7-10,16,19H,4-6,11-13H2,1-3H3