methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoate

Systemtic Name: methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoate Openeye Name: methyl 2-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-4-sulfanyl-butanoate CAS Name: 4-mercapto-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-4-sulfanylbutanoate Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-4-mercapto-butyric acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCS)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCS)C(=O)OC

InChI

InChI=1S/C19H28N2O5S/c1-19(2,3)26-18(24)21-15(12-13-8-6-5-7-9-13)16(22)20-14(10-11-27)17(23)25-4/h5-9,14-15,27H,10-12H2,1-4H3,(H,20,22)(H,21,24)