1-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide Openeye Name: 1-(3,3-dimethyl-2-oxo-butyl)sulfanyl-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide CAS Name: 1-[(3,3-dimethyl-2-oxobutyl)thio]-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide IUPAC Name: 1-(3,3-dimethyl-2-oxobutyl)sulfanyl-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide Traditional Name: 1-[(2-keto-3,3-dimethyl-butyl)thio]-N,N-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzoxazole-7-sulfonamide Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C2N1C3=C(O2)C=CC(=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C2N1C3=C(O2)C=CC(=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C16H20N4O4S2/c1-16(2,3)13(21)9-25-15-18-17-14-20(15)11-8-10(6-7-12(11)24-14)26(22,23)19(4)5/h6-8H,9H2,1-5H3