tert-butyl (3S)-5-[(2-chlorophenyl)methylsulfanyl]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-pentanoate

Systemtic Name: tert-butyl (3S)-5-[(2-chlorophenyl)methylsulfanyl]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-pentanoate Openeye Name: tert-butyl (3S)-5-[(2-chlorophenyl)methylsulfanyl]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-pentanoate CAS Name: (3S)-5-[(2-chlorophenyl)methylthio]-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-5-[(2-chlorophenyl)methylsulfanyl]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxopentanoate Traditional Name: (3S)-5-[(2-chlorobenzyl)thio]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-valeric acid tert-butyl ester Formula: C31H32ClNO5S MolecularWeight: 566.10748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)CSCC1=CC=CC=C1Cl)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](C(=O)CSCC1=CC=CC=C1Cl)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C31H32ClNO5S/c1-31(2,3)38-29(35)16-27(28(34)19-39-18-20-10-4-9-15-26(20)32)33-30(36)37-17-25-23-13-7-5-11-21(23)22-12-6-8-14-24(22)25/h4-15,25,27H,16-19H2,1-3H3,(H,33,36)/t27-/m0/s1