(2R)-2-[deuterio-(4-methylphenyl)sulfonyl-amino]-3-methyl-3-(phenylmethylsulfanyl)butanoic acid

Systemtic Name: (2R)-2-[deuterio-(4-methylphenyl)sulfonyl-amino]-3-methyl-3-(phenylmethylsulfanyl)butanoic acid Openeye Name: (2R)-3-benzylsulfanyl-2-[deuterio(p-tolylsulfonyl)amino]-3-methyl-butanoic acid CAS Name: (2R)-2-[deuterio-(4-methylphenyl)sulfonylamino]-3-methyl-3-(phenylmethylthio)butanoic acid IUPAC Name: (2R)-3-benzylsulfanyl-2-[deuterio-(4-methylphenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: (2R)-3-(benzylthio)-2-[deuterio(tosyl)amino]-3-methyl-butyric acid Formula: C19H23NO4S2 MolecularWeight: 394.526382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(=O)O)C(C)(C)SCC2=CC=CC=C2

Isomeric SMILES

[2H]N([C@H](C(=O)O)C(C)(C)SCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H23NO4S2/c1-14-9-11-16(12-10-14)26(23,24)20-17(18(21)22)19(2,3)25-13-15-7-5-4-6-8-15/h4-12,17,20H,13H2,1-3H3,(H,21,22)/t17-/m1/s1/i/hD