ethyl (2S,3R)-3-[[(R)-tert-butylsulfinyl]amino]-3-phenyl-2-(phenylmethyl)propanoate

Systemtic Name: ethyl (2S,3R)-3-[[(R)-tert-butylsulfinyl]amino]-3-phenyl-2-(phenylmethyl)propanoate Openeye Name: ethyl (2S,3R)-2-benzyl-3-[[(R)-tert-butylsulfinyl]amino]-3-phenyl-propanoate CAS Name: (2S,3R)-3-[[(R)-tert-butylsulfinyl]amino]-3-phenyl-2-(phenylmethyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-benzyl-3-[[(R)-tert-butylsulfinyl]amino]-3-phenylpropanoate Traditional Name: (2S,3R)-2-benzyl-3-[[(R)-tert-butylsulfinyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)C(C2=CC=CC=C2)NS(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H](CC1=CC=CC=C1)[C@H](C2=CC=CC=C2)N[S@](=O)C(C)(C)C

InChI

InChI=1S/C22H29NO3S/c1-5-26-21(24)19(16-17-12-8-6-9-13-17)20(18-14-10-7-11-15-18)23-27(25)22(2,3)4/h6-15,19-20,23H,5,16H2,1-4H3/t19-,20-,27+/m0/s1