methyl (2R)-2-[(5-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[(5-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(5-fluoro-3-methyl-benzofuran-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(5-fluoro-3-methyl-2-benzofuranyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(5-fluoro-3-methyl-1-benzofuran-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(5-fluoro-3-methyl-benzofuran-2-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C16H18FNO4S MolecularWeight: 339.381823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)F)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)F)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H18FNO4S/c1-9-11-8-10(17)4-5-13(11)22-14(9)15(19)18-12(6-7-23-3)16(20)21-2/h4-5,8,12H,6-7H2,1-3H3,(H,18,19)/t12-/m1/s1