methyl (2R)-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(3-fluoro-4-methyl-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(3-fluoro-4-methylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-fluoro-4-methylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(3-fluoro-4-methyl-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C14H18FNO3S MolecularWeight: 299.361023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CCSC)C(=O)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H](CCSC)C(=O)OC)F

InChI

InChI=1S/C14H18FNO3S/c1-9-4-5-10(8-11(9)15)13(17)16-12(6-7-20-3)14(18)19-2/h4-5,8,12H,6-7H2,1-3H3,(H,16,17)/t12-/m1/s1