tert-butyl-[6-(carbamothioylamino)-1,3-benzothiazol-2-yl]-dimethyl-azanium

Systemtic Name: tert-butyl-[6-(carbamothioylamino)-1,3-benzothiazol-2-yl]-dimethyl-azanium Openeye Name: tert-butyl-[6-(carbamothioylamino)-1,3-benzothiazol-2-yl]-dimethyl-ammonium CAS Name: tert-butyl-[6-(carbamothioylamino)-1,3-benzothiazol-2-yl]-dimethylammonium IUPAC Name: tert-butyl-[6-(carbamothioylamino)-1,3-benzothiazol-2-yl]-dimethylazanium Traditional Name: tert-butyl-dimethyl-(6-thioureido-1,3-benzothiazol-2-yl)ammonium Formula: C14H21N4S2+ MolecularWeight: 309.47334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](C)(C)C1=NC2=C(S1)C=C(C=C2)NC(=S)N

Isomeric SMILES

CC(C)(C)[N+](C)(C)C1=NC2=C(S1)C=C(C=C2)NC(=S)N

InChI

InChI=1S/C14H20N4S2/c1-14(2,3)18(4,5)13-17-10-7-6-9(16-12(15)19)8-11(10)20-13/h6-8H,1-5H3,(H2-,15,16,19)/p+1