[(2S,3S,4S)-2-methyl-6-phenylsulfanyl-4-(prop-2-enoxycarbonylamino)oxan-3-yl] ethanoate

Systemtic Name: [(2S,3S,4S)-2-methyl-6-phenylsulfanyl-4-(prop-2-enoxycarbonylamino)oxan-3-yl] ethanoate Openeye Name: [(2S,3S,4S)-4-(allyloxycarbonylamino)-2-methyl-6-phenylsulfanyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3S,4S)-2-methyl-4-[[oxo(prop-2-enoxy)methyl]amino]-6-(phenylthio)-3-oxanyl] ester IUPAC Name: [(2S,3S,4S)-2-methyl-6-phenylsulfanyl-4-(prop-2-enoxycarbonylamino)oxan-3-yl] acetate Traditional Name: acetic acid [(2S,3S,4S)-4-(allyloxycarbonylamino)-2-methyl-6-(phenylthio)tetrahydropyran-3-yl] ester Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)SC2=CC=CC=C2)NC(=O)OCC=C)OC(=O)C

Isomeric SMILES

C[C@H]1[C@H]([C@H](CC(O1)SC2=CC=CC=C2)NC(=O)OCC=C)OC(=O)C

InChI

InChI=1S/C18H23NO5S/c1-4-10-22-18(21)19-15-11-16(25-14-8-6-5-7-9-14)23-12(2)17(15)24-13(3)20/h4-9,12,15-17H,1,10-11H2,2-3H3,(H,19,21)/t12-,15-,16?,17+/m0/s1