tert-butyl N-[(2S,3S)-1-naphthalen-2-ylsulfanyl-2-oxidanyl-5-phenyl-pentan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S)-1-naphthalen-2-ylsulfanyl-2-oxidanyl-5-phenyl-pentan-3-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-2-hydroxy-3-(2-naphthylsulfanyl)-1-phenethyl-propyl]carbamate CAS Name: N-[(2S,3S)-2-hydroxy-1-(2-naphthalenylthio)-5-phenylpentan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S)-2-hydroxy-1-naphthalen-2-ylsulfanyl-5-phenylpentan-3-yl]carbamate Traditional Name: N-[(1S,2S)-2-hydroxy-3-(2-naphthylthio)-1-phenethyl-propyl]carbamic acid tert-butyl ester Formula: C26H31NO3S MolecularWeight: 437.59424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=CC=CC=C1)C(CSC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC1=CC=CC=C1)[C@@H](CSC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C26H31NO3S/c1-26(2,3)30-25(29)27-23(16-13-19-9-5-4-6-10-19)24(28)18-31-22-15-14-20-11-7-8-12-21(20)17-22/h4-12,14-15,17,23-24,28H,13,16,18H2,1-3H3,(H,27,29)/t23-,24+/m0/s1