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

Systemtic Name: methyl 2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-bromophenyl)sulfanyl-propanoate Openeye Name: methyl 2-[bis(tert-butoxycarbonyl)amino]-3-(4-bromophenyl)sulfanyl-propanoate CAS Name: 2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(4-bromophenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-bromophenyl)sulfanylpropanoate Traditional Name: 2-[bis(tert-butoxycarbonyl)amino]-3-[(4-bromophenyl)thio]propionic acid methyl ester Formula: C20H28BrNO6S MolecularWeight: 490.40842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28BrNO6S/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,12H2,1-7H3