tert-butyl N-[(2S,3R)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-1-benzyl-3-[(4-fluorophenyl)sulfonyl-methyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[(4-fluorophenyl)sulfonyl-methylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-4-[(4-fluorophenyl)sulfonyl-methylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-[(4-fluorophenyl)sulfonyl-methyl-amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C22H29FN2O5S MolecularWeight: 452.539463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(C)S(=O)(=O)C2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CN(C)S(=O)(=O)C2=CC=C(C=C2)F)O

InChI

InChI=1S/C22H29FN2O5S/c1-22(2,3)30-21(27)24-19(14-16-8-6-5-7-9-16)20(26)15-25(4)31(28,29)18-12-10-17(23)11-13-18/h5-13,19-20,26H,14-15H2,1-4H3,(H,24,27)/t19-,20+/m0/s1