tert-butyl N-[(1R,2R)-1-tert-butylsulfanyl-1-(2,4-dimethoxyphenyl)-3-oxidanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(1R,2R)-1-tert-butylsulfanyl-1-(2,4-dimethoxyphenyl)-3-oxidanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R,2R)-2-tert-butylsulfanyl-2-(2,4-dimethoxyphenyl)-1-(hydroxymethyl)ethyl]carbamate CAS Name: N-[(1R,2R)-1-(tert-butylthio)-1-(2,4-dimethoxyphenyl)-3-hydroxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,2R)-1-tert-butylsulfanyl-1-(2,4-dimethoxyphenyl)-3-hydroxypropan-2-yl]carbamate Traditional Name: N-[(1R,2R)-2-(tert-butylthio)-2-(2,4-dimethoxyphenyl)-1-methylol-ethyl]carbamic acid tert-butyl ester Formula: C20H33NO5S MolecularWeight: 399.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CO)C(C1=C(C=C(C=C1)OC)OC)SC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CO)[C@@H](C1=C(C=C(C=C1)OC)OC)SC(C)(C)C

InChI

InChI=1S/C20H33NO5S/c1-19(2,3)26-18(23)21-15(12-22)17(27-20(4,5)6)14-10-9-13(24-7)11-16(14)25-8/h9-11,15,17,22H,12H2,1-8H3,(H,21,23)/t15-,17-/m1/s1