tert-butyl N-[(2S,3R)-3-oxidanyl-1-(phenylmethylsulfanyl)pent-4-en-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-3-oxidanyl-1-(phenylmethylsulfanyl)pent-4-en-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-1-(benzylsulfanylmethyl)-2-hydroxy-but-3-enyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-1-(phenylmethylthio)pent-4-en-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-1-benzylsulfanyl-3-hydroxypent-4-en-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-[(benzylthio)methyl]-2-hydroxy-but-3-enyl]carbamic acid tert-butyl ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1=CC=CC=C1)C(C=C)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CSCC1=CC=CC=C1)[C@@H](C=C)O

InChI

InChI=1S/C17H25NO3S/c1-5-15(19)14(18-16(20)21-17(2,3)4)12-22-11-13-9-7-6-8-10-13/h5-10,14-15,19H,1,11-12H2,2-4H3,(H,18,20)/t14-,15-/m1/s1