ethyl 2-[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]sulfanylethanoate Openeye Name: ethyl 2-[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]sulfanylacetate CAS Name: 2-[[(2S)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]sulfanylacetate Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]thio]acetic acid ethyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CSC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23NO5S/c1-2-26-19(23)15-28-20(24)18(13-16-9-5-3-6-10-16)22-21(25)27-14-17-11-7-4-8-12-17/h3-12,18H,2,13-15H2,1H3,(H,22,25)/t18-/m0/s1