methyl (2R)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanyl-propanoyl]amino]-3-sulfanyl-propanoate

Systemtic Name: methyl (2R)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanyl-propanoyl]amino]-3-sulfanyl-propanoate Openeye Name: methyl (2R)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenylselanyl-propanoyl]amino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-(phenylseleno)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylselanylpropanoyl]amino]-3-sulfanylpropanoate Traditional Name: (2R)-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-(phenylseleno)propanoyl]amino]-3-mercapto-propionic acid methyl ester Formula: C18H26N2O5SSe MolecularWeight: 461.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C[Se]C1=CC=CC=C1)C(=O)NC(CS)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C[Se]C1=CC=CC=C1)C(=O)N[C@@H](CS)C(=O)OC

InChI

InChI=1S/C18H26N2O5SSe/c1-18(2,3)25-17(23)20-14(11-27-12-8-6-5-7-9-12)15(21)19-13(10-26)16(22)24-4/h5-9,13-14,26H,10-11H2,1-4H3,(H,19,21)(H,20,23)/t13-,14-/m0/s1