methyl (2R)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenylsulfanyl-propanoate

Systemtic Name: methyl (2R)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenylsulfanyl-propanoate Openeye Name: methyl (2R)-2-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]-3-phenylsulfanyl-propanoate CAS Name: (2R)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenylsulfanylpropanoate Traditional Name: (2R)-2-[tert-butoxycarbonyl(tosyl)amino]-3-(phenylthio)propionic acid methyl ester Formula: C22H27NO6S2 MolecularWeight: 465.58288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(CSC2=CC=CC=C2)C(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N([C@@H](CSC2=CC=CC=C2)C(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H27NO6S2/c1-16-11-13-18(14-12-16)31(26,27)23(21(25)29-22(2,3)4)19(20(24)28-5)15-30-17-9-7-6-8-10-17/h6-14,19H,15H2,1-5H3/t19-/m0/s1