3-[[2-cyanoethyl(furan-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-cyanoethyl(furan-2-ylmethyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-cyanoethyl(2-furylmethyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[2-cyanoethyl(2-furanylmethyl)amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-cyanoethyl(furan-2-ylmethyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-cyanoethyl(2-furfuryl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C14H23N4OS+ MolecularWeight: 295.42362

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(CCC#N)CC1=CC=CO1

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(CCC#N)CC1=CC=CO1

InChI

InChI=1S/C14H22N4OS/c1-17(2)9-5-8-16-14(20)18(10-4-7-15)12-13-6-3-11-19-13/h3,6,11H,4-5,8-10,12H2,1-2H3,(H,16,20)/p+1