2-[[4-[[2-(dimethylazaniumyl)ethylcarbamothioylamino]methyl]phenyl]methylcarbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-[[2-(dimethylazaniumyl)ethylcarbamothioylamino]methyl]phenyl]methylcarbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-[[2-(dimethylammonio)ethylcarbamothioylamino]methyl]phenyl]methylcarbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[4-[[[[2-(dimethylammonio)ethylamino]-sulfanylidenemethyl]amino]methyl]phenyl]methylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-[[2-(dimethylazaniumyl)ethylcarbamothioylamino]methyl]phenyl]methylcarbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[4-[[2-(dimethylammonio)ethylthiocarbamoylamino]methyl]benzyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C18H34N6S2+2 MolecularWeight: 398.63276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCC1=CC=C(C=C1)CNC(=S)NCC[NH+](C)C

Isomeric SMILES

C[NH+](C)CCNC(=S)NCC1=CC=C(C=C1)CNC(=S)NCC[NH+](C)C

InChI

InChI=1S/C18H32N6S2/c1-23(2)11-9-19-17(25)21-13-15-5-7-16(8-6-15)14-22-18(26)20-10-12-24(3)4/h5-8H,9-14H2,1-4H3,(H2,19,21,25)(H2,20,22,26)/p+2