methyl 2-[2-(2-fluorophenyl)sulfanylethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-(2-fluorophenyl)sulfanylethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-fluorophenyl)thio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-fluorophenyl)thio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C15H20FNO3S MolecularWeight: 313.387603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSC1=CC=CC=C1F

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CSC1=CC=CC=C1F

InChI

InChI=1S/C15H20FNO3S/c1-10(2)8-12(15(19)20-3)17-14(18)9-21-13-7-5-4-6-11(13)16/h4-7,10,12H,8-9H2,1-3H3,(H,17,18)