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

Systemtic Name: N-(4-hexoxyphenyl)-3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine Openeye Name: N-(4-hexoxyphenyl)-3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-amine CAS Name: N-(4-hexoxyphenyl)-3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-4-imidazolidin-3-iumamine IUPAC Name: N-(4-hexoxyphenyl)-3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidoimidazolidin-3-ium-4-amine Traditional Name: (4-hexoxyphenyl)-[3-(5-hexylsulfonyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]amine Formula: C24H39N5O4S2 MolecularWeight: 525.72756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC2CN(C[N+]2(C3=NN=C(S3)S(=O)(=O)CCCCCC)[O-])C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC2CN(C[N+]2(C3=NN=C(S3)S(=O)(=O)CCCCCC)[O-])C

InChI

InChI=1S/C24H39N5O4S2/c1-4-6-8-10-16-33-21-14-12-20(13-15-21)25-22-18-28(3)19-29(22,30)23-26-27-24(34-23)35(31,32)17-11-9-7-5-2/h12-15,22,25H,4-11,16-19H2,1-3H3