2-[(2-methylpropan-2-yl)oxycarbonyl-[2-(phenylmethylsulfanyl)ethyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[2-(phenylmethylsulfanyl)ethyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[2-benzylsulfanylethyl(tert-butoxycarbonyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[2-(phenylmethylthio)ethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[2-benzylsulfanylethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[2-(benzylthio)ethyl-tert-butoxycarbonyl-amino]-3-phenyl-propionic acid Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCSCC1=CC=CC=C1)C(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CCSCC1=CC=CC=C1)C(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C23H29NO4S/c1-23(2,3)28-22(27)24(14-15-29-17-19-12-8-5-9-13-19)20(21(25)26)16-18-10-6-4-7-11-18/h4-13,20H,14-17H2,1-3H3,(H,25,26)