(2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-4-(methylthio)butyric acid Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(CCSC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)[C@H](CCSC)C(=O)O

InChI

InChI=1S/C19H23NO5S2/c1-25-16-8-10-17(11-9-16)27(23,24)20(14-15-6-4-3-5-7-15)18(19(21)22)12-13-26-2/h3-11,18H,12-14H2,1-2H3,(H,21,22)/t18-/m1/s1