[(2S)-1-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-1-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-2-[(6-amino-1,3-benzothiazol-2-yl)amino]-1-methyl-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [(2S)-1-[(6-amino-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]-dimethylammonium IUPAC Name: [(2S)-1-[(6-amino-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]-dimethylazanium Traditional Name: [(1S)-2-[(6-amino-1,3-benzothiazol-2-yl)amino]-2-keto-1-methyl-ethyl]-dimethyl-ammonium Formula: C12H17N4OS+ MolecularWeight: 265.35458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)N)[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=NC2=C(S1)C=C(C=C2)N)[NH+](C)C

InChI

InChI=1S/C12H16N4OS/c1-7(16(2)3)11(17)15-12-14-9-5-4-8(13)6-10(9)18-12/h4-7H,13H2,1-3H3,(H,14,15,17)/p+1/t7-/m0/s1