methyl (2R)-2-[3-(4-methylphenyl)sulfonylpropanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[3-(4-methylphenyl)sulfonylpropanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-4-methylsulfanyl-2-[3-(p-tolylsulfonyl)propanoylamino]butanoate CAS Name: (2R)-2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-(4-methylphenyl)sulfonylpropanoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-(3-tosylpropanoylamino)butyric acid methyl ester Formula: C16H23NO5S2 MolecularWeight: 373.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H23NO5S2/c1-12-4-6-13(7-5-12)24(20,21)11-9-15(18)17-14(8-10-23-3)16(19)22-2/h4-7,14H,8-11H2,1-3H3,(H,17,18)/t14-/m1/s1