(4-azanyl-4-oxidanylidene-butanethioyl)-bis(2-ethylhexyl)-sulfanyl-azanium

Systemtic Name: (4-azanyl-4-oxidanylidene-butanethioyl)-bis(2-ethylhexyl)-sulfanyl-azanium Openeye Name: (4-amino-4-oxo-butanethioyl)-bis(2-ethylhexyl)-sulfanyl-ammonium CAS Name: (4-amino-4-oxo-1-sulfanylidenebutyl)-bis(2-ethylhexyl)-mercaptoammonium IUPAC Name: (4-amino-4-oxobutanethioyl)-bis(2-ethylhexyl)-sulfanylazanium Traditional Name: (4-amino-4-keto-butanethioyl)-bis(2-ethylhexyl)-mercapto-ammonium Formula: C20H41N2OS2+ MolecularWeight: 389.68234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[N+](CC(CC)CCCC)(C(=S)CCC(=O)N)S

Isomeric SMILES

CCCCC(CC)C[N+](CC(CC)CCCC)(C(=S)CCC(=O)N)S

InChI

InChI=1S/C20H40N2OS2/c1-5-9-11-17(7-3)15-22(25,20(24)14-13-19(21)23)16-18(8-4)12-10-6-2/h17-18,25H,5-16H2,1-4H3,(H-,21,23)/p+1