ditert-butyl (2R,3R)-2-[bis(2-hydroxyethyl)carbamothioyloxy]-3-oxidanyl-butanedioate

Systemtic Name: ditert-butyl (2R,3R)-2-[bis(2-hydroxyethyl)carbamothioyloxy]-3-oxidanyl-butanedioate Openeye Name: ditert-butyl (2R,3R)-2-[bis(2-hydroxyethyl)carbamothioyloxy]-3-hydroxy-butanedioate CAS Name: (2R,3R)-2-[[bis(2-hydroxyethyl)amino]-sulfanylidenemethoxy]-3-hydroxybutanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2R,3R)-2-[bis(2-hydroxyethyl)carbamothioyloxy]-3-hydroxybutanedioate Traditional Name: (2R,3R)-2-[bis(2-hydroxyethyl)thiocarbamoyloxy]-3-hydroxy-succinic acid ditert-butyl ester Formula: C17H31NO8S MolecularWeight: 409.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(C(=O)OC(C)(C)C)OC(=S)N(CCO)CCO)O

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]([C@H](C(=O)OC(C)(C)C)OC(=S)N(CCO)CCO)O

InChI

InChI=1S/C17H31NO8S/c1-16(2,3)25-13(22)11(21)12(14(23)26-17(4,5)6)24-15(27)18(7-9-19)8-10-20/h11-12,19-21H,7-10H2,1-6H3/t11-,12-/m1/s1