tert-butyl (2S)-4-ethylsulfanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: tert-butyl (2S)-4-ethylsulfanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: tert-butyl (2S)-2-(benzyloxycarbonylamino)-4-ethylsulfanyl-4-oxo-butanoate CAS Name: (2S)-4-(ethylthio)-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-ethylsulfanyl-4-oxo-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-(ethylthio)-4-keto-butyric acid tert-butyl ester Formula: C18H25NO5S MolecularWeight: 367.4598

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC(C(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCSC(=O)C[C@@H](C(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H25NO5S/c1-5-25-15(20)11-14(16(21)24-18(2,3)4)19-17(22)23-12-13-9-7-6-8-10-13/h6-10,14H,5,11-12H2,1-4H3,(H,19,22)/t14-/m0/s1