(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-phenylmethoxy-3-thiophen-3-yl-phenyl)propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-phenylmethoxy-3-thiophen-3-yl-phenyl)propanoate Openeye Name: benzyl (2S)-3-[4-benzyloxy-3-(3-thienyl)phenyl]-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-phenylmethoxy-3-(3-thiophenyl)phenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-phenylmethoxy-3-thiophen-3-ylphenyl)propanoate Traditional Name: (2S)-3-[4-benzoxy-3-(3-thienyl)phenyl]-2-(tert-butoxycarbonylamino)propionic acid benzyl ester Formula: C32H33NO5S MolecularWeight: 543.67312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H33NO5S/c1-32(2,3)38-31(35)33-28(30(34)37-21-24-12-8-5-9-13-24)19-25-14-15-29(27(18-25)26-16-17-39-22-26)36-20-23-10-6-4-7-11-23/h4-18,22,28H,19-21H2,1-3H3,(H,33,35)/t28-/m0/s1