S-tert-butyl (3R,4S,5S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-2,2-dimethyl-3-oxidanyl-4-phenylselanyl-hexanethioate

Systemtic Name: S-tert-butyl (3R,4S,5S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-2,2-dimethyl-3-oxidanyl-4-phenylselanyl-hexanethioate Openeye Name: S-tert-butyl (3R,4S,5S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-2,2-dimethyl-4-phenylselanyl-hexanethioate CAS Name: (3R,4S,5S)-5-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-hydroxy-2,2-dimethyl-4-(phenylseleno)hexanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3R,4S,5S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-2,2-dimethyl-4-phenylselanylhexanethioate Traditional Name: (3R,4S,5S)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-2,2-dimethyl-4-(phenylseleno)hexanethioic acid S-tert-butyl ester Formula: C33H39NO4SSe MolecularWeight: 624.69206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C(C)(C)C(=O)SC(C)(C)C)O)[Se]C1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

C[C@@H]([C@@H]([C@@H](C(C)(C)C(=O)SC(C)(C)C)O)[Se]C1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C33H39NO4SSe/c1-21(28(40-22-14-8-7-9-15-22)29(35)33(5,6)30(36)39-32(2,3)4)34-31(37)38-20-27-25-18-12-10-16-23(25)24-17-11-13-19-26(24)27/h7-19,21,27-29,35H,20H2,1-6H3,(H,34,37)/t21-,28-,29-/m0/s1