2-[[1,3-benzothiazol-2-ylmethyl(methyl)carbamothioyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)carbamothioyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[1,3-benzothiazol-2-ylmethyl(methyl)amino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C14H21N4S2+ MolecularWeight: 309.47334

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)N(C)CC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[NH+](C)CCNC(=S)N(C)CC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H20N4S2/c1-17(2)9-8-15-14(19)18(3)10-13-16-11-6-4-5-7-12(11)20-13/h4-7H,8-10H2,1-3H3,(H,15,19)/p+1