2-[[3-[2-(dimethylazaniumyl)ethylcarbamothioylamino]-4-methyl-phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-[2-(dimethylazaniumyl)ethylcarbamothioylamino]-4-methyl-phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-[2-(dimethylammonio)ethylcarbamothioylamino]-4-methyl-phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-[[[2-(dimethylammonio)ethylamino]-sulfanylidenemethyl]amino]-4-methylanilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-[2-(dimethylazaniumyl)ethylcarbamothioylamino]-4-methylphenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[3-[2-(dimethylammonio)ethylthiocarbamoylamino]-4-methyl-phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H32N6S2+2 MolecularWeight: 384.60618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC[NH+](C)C)NC(=S)NCC[NH+](C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC[NH+](C)C)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C17H30N6S2/c1-13-6-7-14(20-16(24)18-8-10-22(2)3)12-15(13)21-17(25)19-9-11-23(4)5/h6-7,12H,8-11H2,1-5H3,(H2,18,20,24)(H2,19,21,25)/p+2