methyl (2R)-3-(4-aminophenyl)sulfanyl-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate

Systemtic Name: methyl (2R)-3-(4-aminophenyl)sulfanyl-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate Openeye Name: methyl (2R)-3-(4-aminophenyl)sulfanyl-2-[bis(tert-butoxycarbonyl)amino]propanoate CAS Name: (2R)-3-[(4-aminophenyl)thio]-2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(4-aminophenyl)sulfanyl-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate Traditional Name: (2R)-3-[(4-aminophenyl)thio]-2-[bis(tert-butoxycarbonyl)amino]propionic acid methyl ester Formula: C20H30N2O6S MolecularWeight: 426.527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CSC1=CC=C(C=C1)N)C(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N([C@@H](CSC1=CC=C(C=C1)N)C(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H30N2O6S/c1-19(2,3)27-17(24)22(18(25)28-20(4,5)6)15(16(23)26-7)12-29-14-10-8-13(21)9-11-14/h8-11,15H,12,21H2,1-7H3/t15-/m0/s1