S-(phenylmethyl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanethioate

Systemtic Name: S-(phenylmethyl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanethioate Openeye Name: S-benzyl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanethioate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-phenylpropanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanethioate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenyl-propanethioic acid S-benzyl ester Formula: C31H27NO3S MolecularWeight: 493.61598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)SCC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)SCC2=CC=CC=C2)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C31H27NO3S/c33-30(36-21-23-13-5-2-6-14-23)29(19-22-11-3-1-4-12-22)32-31(34)35-20-28-26-17-9-7-15-24(26)25-16-8-10-18-27(25)28/h1-18,28-29H,19-21H2,(H,32,34)/t29-/m0/s1