5-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]-1,3-benzothiazol-2-olate

Systemtic Name: 5-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]-1,3-benzothiazol-2-olate Openeye Name: 5-[[(1S)-1-carbamoyl-3-methyl-butyl]sulfamoyl]-1,3-benzothiazol-2-olate CAS Name: 5-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]sulfamoyl]-1,3-benzothiazol-2-olate IUPAC Name: 5-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]sulfamoyl]-1,3-benzothiazol-2-olate Traditional Name: 5-[[(1S)-1-carbamoyl-3-methyl-butyl]sulfamoyl]-1,3-benzothiazol-2-olate Formula: C13H16N3O4S2- MolecularWeight: 342.41384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)[O-]

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)NS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)[O-]

InChI

InChI=1S/C13H17N3O4S2/c1-7(2)5-10(12(14)17)16-22(19,20)8-3-4-11-9(6-8)15-13(18)21-11/h3-4,6-7,10,16H,5H2,1-2H3,(H2,14,17)(H,15,18)/p-1/t10-/m0/s1