3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylmethoxyphenyl)methylsulfanyl]butanoic acid

Systemtic Name: 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylmethoxyphenyl)methylsulfanyl]butanoic acid Openeye Name: 3-[(4-benzyloxyphenyl)methylsulfanyl]-2-(tert-butoxycarbonylamino)-3-methyl-butanoic acid CAS Name: 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(4-phenylmethoxyphenyl)methylthio]butanoic acid IUPAC Name: 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylmethoxyphenyl)methylsulfanyl]butanoic acid Traditional Name: 3-[(4-benzoxybenzyl)thio]-2-(tert-butoxycarbonylamino)-3-methyl-butyric acid Formula: C24H31NO5S MolecularWeight: 445.57164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)O)C(C)(C)SCC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(=O)O)C(C)(C)SCC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C24H31NO5S/c1-23(2,3)30-22(28)25-20(21(26)27)24(4,5)31-16-18-11-13-19(14-12-18)29-15-17-9-7-6-8-10-17/h6-14,20H,15-16H2,1-5H3,(H,25,28)(H,26,27)