(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]sulfanyl-propanoic acid Openeye Name: (2R)-3-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]sulfanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid CAS Name: (2R)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]thio]propanoic acid IUPAC Name: (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]sulfanylpropanoic acid Traditional Name: (2R)-3-[[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]thio]-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid Formula: C33H36N2O8S MolecularWeight: 620.71254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CSC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H36N2O8S/c1-33(2,3)43-32(40)35-28(30(38)41-17-21-11-5-4-6-12-21)20-44-19-27(29(36)37)34-31(39)42-18-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26/h4-16,26-28H,17-20H2,1-3H3,(H,34,39)(H,35,40)(H,36,37)/t27-,28+/m0/s1