(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-keto-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H25NO4S2 MolecularWeight: 443.5789

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)N2CCSC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)N2CCSC3=CC=CC=C32

InChI

InChI=1S/C23H25NO4S2/c1-23(2,3)20(25)14-28-22(27)16-8-4-6-10-18(16)30-15-21(26)24-12-13-29-19-11-7-5-9-17(19)24/h4-11H,12-15H2,1-3H3