(3-fluoranyl-4-methoxy-phenyl)methyl (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid (3-fluoro-4-methoxy-benzyl) ester Formula: C14H19FN2O4S MolecularWeight: 330.375063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C(CCSC)NC(=O)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)[C@@H](CCSC)NC(=O)N)F

InChI

InChI=1S/C14H19FN2O4S/c1-20-12-4-3-9(7-10(12)15)8-21-13(18)11(5-6-22-2)17-14(16)19/h3-4,7,11H,5-6,8H2,1-2H3,(H3,16,17,19)/t11-/m1/s1