[azanyl-(2,2-dimethylpropanoylamino)methylidene]-(1,3-benzothiazol-2-yl)azanium

Systemtic Name: [azanyl-(2,2-dimethylpropanoylamino)methylidene]-(1,3-benzothiazol-2-yl)azanium Openeye Name: [amino-(2,2-dimethylpropanoylamino)methylene]-(1,3-benzothiazol-2-yl)ammonium CAS Name: [amino-[(2,2-dimethyl-1-oxopropyl)amino]methylidene]-(1,3-benzothiazol-2-yl)ammonium IUPAC Name: [amino-(2,2-dimethylpropanoylamino)methylidene]-(1,3-benzothiazol-2-yl)azanium Traditional Name: [amino-(pivaloylamino)methylene]-(1,3-benzothiazol-2-yl)ammonium Formula: C13H17N4OS+ MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=[NH+]C1=NC2=CC=CC=C2S1)N

Isomeric SMILES

CC(C)(C)C(=O)NC(=[NH+]C1=NC2=CC=CC=C2S1)N

InChI

InChI=1S/C13H16N4OS/c1-13(2,3)10(18)16-11(14)17-12-15-8-6-4-5-7-9(8)19-12/h4-7H,1-3H3,(H3,14,15,16,17,18)/p+1