ethyl 2-[[3-(methoxycarbonyldisulfanyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[3-(methoxycarbonyldisulfanyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoate Openeye Name: ethyl 2-[[2-(benzyloxycarbonylamino)-3-(methoxycarbonyldisulfanyl)propanoyl]amino]acetate CAS Name: 2-[[3-(methoxycarbonyldisulfanyl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-(methoxycarbonyldisulfanyl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-(carbomethoxydisulfanyl)propanoyl]amino]acetic acid ethyl ester Formula: C17H22N2O7S2 MolecularWeight: 430.49578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CSSC(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CNC(=O)C(CSSC(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H22N2O7S2/c1-3-25-14(20)9-18-15(21)13(11-27-28-17(23)24-2)19-16(22)26-10-12-7-5-4-6-8-12/h4-8,13H,3,9-11H2,1-2H3,(H,18,21)(H,19,22)