ethyl 4-methylsulfanyl-2-(2-methylsulfanylethyl)-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: ethyl 4-methylsulfanyl-2-(2-methylsulfanylethyl)-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-4-methylsulfanyl-2-(2-methylsulfanylethyl)butanoate CAS Name: 4-(methylthio)-2-[2-(methylthio)ethyl]-2-(phenylmethoxycarbonylamino)butanoic acid ethyl ester IUPAC Name: ethyl 4-methylsulfanyl-2-(2-methylsulfanylethyl)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-4-(methylthio)-2-[2-(methylthio)ethyl]butyric acid ethyl ester Formula: C18H27NO4S2 MolecularWeight: 385.54128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO4S2/c1-4-22-16(20)18(10-12-24-2,11-13-25-3)19-17(21)23-14-15-8-6-5-7-9-15/h5-9H,4,10-14H2,1-3H3,(H,19,21)