1-[(2R)-2-(3,3-dimethyl-2-oxidanylidene-butyl)-2-oxidanyl-1,4-benzothiazin-3-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[(2R)-2-(3,3-dimethyl-2-oxidanylidene-butyl)-2-oxidanyl-1,4-benzothiazin-3-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[(2R)-2-(3,3-dimethyl-2-oxo-butyl)-2-hydroxy-1,4-benzothiazin-3-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[(2R)-2-(3,3-dimethyl-2-oxobutyl)-2-hydroxy-1,4-benzothiazin-3-yl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[(2R)-2-(3,3-dimethyl-2-oxobutyl)-2-hydroxy-1,4-benzothiazin-3-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-[(2R)-2-hydroxy-2-(2-keto-3,3-dimethyl-butyl)-1,4-benzothiazin-3-yl]-3,3-dimethyl-butan-2-one Formula: C20H27NO3S MolecularWeight: 361.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC1=NC2=CC=CC=C2SC1(CC(=O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C(=O)CC1=NC2=CC=CC=C2S[C@@]1(CC(=O)C(C)(C)C)O

InChI

InChI=1S/C20H27NO3S/c1-18(2,3)16(22)11-15-20(24,12-17(23)19(4,5)6)25-14-10-8-7-9-13(14)21-15/h7-10,24H,11-12H2,1-6H3/t20-/m1/s1