N-[3,4-bis(bromanyl)phenyl]-3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine

Systemtic Name: N-[3,4-bis(bromanyl)phenyl]-3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-imidazolidin-3-ium-4-amine Openeye Name: N-(3,4-dibromophenyl)-3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-amine CAS Name: N-(3,4-dibromophenyl)-3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-4-imidazolidin-3-iumamine IUPAC Name: N-(3,4-dibromophenyl)-3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidoimidazolidin-3-ium-4-amine Traditional Name: (3,4-dibromophenyl)-[3-(5-hexylsulfinyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]amine Formula: C18H25Br2N5O2S2 MolecularWeight: 567.3614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25Br2N5O2S2/c1-3-4-5-6-9-29(27)18-23-22-17(28-18)25(26)12-24(2)11-16(25)21-13-7-8-14(19)15(20)10-13/h7-8,10,16,21H,3-6,9,11-12H2,1-2H3