S-[(1R)-1-[(2R,3S)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]ethyl] ethanethioate

Systemtic Name: S-[(1R)-1-[(2R,3S)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]ethyl] ethanethioate Openeye Name: S-[(1R)-1-[(2R,3S)-3-(benzyloxycarbonylamino)-4-oxo-azetidin-2-yl]ethyl] ethanethioate CAS Name: ethanethioic acid S-[(1R)-1-[(2R,3S)-4-oxo-3-(phenylmethoxycarbonylamino)-2-azetidinyl]ethyl] ester IUPAC Name: S-[(1R)-1-[(2R,3S)-4-oxo-3-(phenylmethoxycarbonylamino)azetidin-2-yl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[(1R)-1-[(2R,3S)-3-(benzyloxycarbonylamino)-4-keto-azetidin-2-yl]ethyl] ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)N1)NC(=O)OCC2=CC=CC=C2)SC(=O)C

Isomeric SMILES

C[C@H]([C@H]1[C@@H](C(=O)N1)NC(=O)OCC2=CC=CC=C2)SC(=O)C

InChI

InChI=1S/C15H18N2O4S/c1-9(22-10(2)18)12-13(14(19)16-12)17-15(20)21-8-11-6-4-3-5-7-11/h3-7,9,12-13H,8H2,1-2H3,(H,16,19)(H,17,20)/t9-,12+,13+/m1/s1