2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-(phenylcarbonylsulfanyl)propanoic acid

Systemtic Name: 2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-(phenylcarbonylsulfanyl)propanoic acid Openeye Name: 3-benzoylsulfanyl-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 3-(benzoylthio)-2-[[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-benzoylsulfanyl-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]propanoic acid Traditional Name: 3-(benzoylthio)-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanoyl]amino]propionic acid Formula: C34H30N2O6S MolecularWeight: 594.6768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CSC(=O)C2=CC=CC=C2)C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CSC(=O)C2=CC=CC=C2)C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C34H30N2O6S/c37-31(35-30(32(38)39)21-43-33(40)23-13-5-2-6-14-23)29(19-22-11-3-1-4-12-22)36-34(41)42-20-28-26-17-9-7-15-24(26)25-16-8-10-18-27(25)28/h1-18,28-30H,19-21H2,(H,35,37)(H,36,41)(H,38,39)