[2-(2-azanylethylamino)-3-methyl-3-sulfanyl-butyl]-butyl-ethyl-(2-methyl-2-sulfanyl-propyl)azanium

Systemtic Name: [2-(2-azanylethylamino)-3-methyl-3-sulfanyl-butyl]-butyl-ethyl-(2-methyl-2-sulfanyl-propyl)azanium Openeye Name: [2-(2-aminoethylamino)-3-methyl-3-sulfanyl-butyl]-butyl-ethyl-(2-methyl-2-sulfanyl-propyl)ammonium CAS Name: [2-(2-aminoethylamino)-3-mercapto-3-methylbutyl]-butyl-ethyl-(2-mercapto-2-methylpropyl)ammonium IUPAC Name: [2-(2-aminoethylamino)-3-methyl-3-sulfanylbutyl]-butyl-ethyl-(2-methyl-2-sulfanylpropyl)azanium Traditional Name: [2-(2-aminoethylamino)-3-mercapto-3-methyl-butyl]-butyl-ethyl-(2-mercapto-2-methyl-propyl)ammonium Formula: C17H40N3S2+ MolecularWeight: 350.6496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CC)(CC(C(C)(C)S)NCCN)CC(C)(C)S

Isomeric SMILES

CCCC[N+](CC)(CC(C(C)(C)S)NCCN)CC(C)(C)S

InChI

InChI=1S/C17H39N3S2/c1-7-9-12-20(8-2,14-16(3,4)21)13-15(17(5,6)22)19-11-10-18/h15,19H,7-14,18H2,1-6H3,(H-,21,22)/p+1