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

Systemtic Name: 2-[[2-cyanoethyl(furan-2-ylmethyl)carbamothioyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-cyanoethyl(2-furylmethyl)carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-cyanoethyl(2-furanylmethyl)amino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-cyanoethyl(furan-2-ylmethyl)carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-cyanoethyl(2-furfuryl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C13H21N4OS+ MolecularWeight: 281.39704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4OS/c1-16(2)9-7-15-13(19)17(8-4-6-14)11-12-5-3-10-18-12/h3,5,10H,4,7-9,11H2,1-2H3,(H,15,19)/p+1