N,N-dimethyl-2-(3-oxidanylidenebutan-2-ylsulfanyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-(3-oxidanylidenebutan-2-ylsulfanyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-(1-methyl-2-oxo-propyl)sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N,N-dimethyl-2-(3-oxobutan-2-ylthio)-1,3-benzoxazole-5-sulfonamide IUPAC Name: N,N-dimethyl-2-(3-oxobutan-2-ylsulfanyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(2-keto-1-methyl-propyl)thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C13H16N2O4S2 MolecularWeight: 328.40714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)SC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C(=O)C)SC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C13H16N2O4S2/c1-8(16)9(2)20-13-14-11-7-10(5-6-12(11)19-13)21(17,18)15(3)4/h5-7,9H,1-4H3