methyl (2R)-2-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C15H21FN2O5S2 MolecularWeight: 392.466043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC(CCSC)C(=O)OC)S(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CN(CC(=O)N[C@H](CCSC)C(=O)OC)S(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C15H21FN2O5S2/c1-18(25(21,22)12-6-4-11(16)5-7-12)10-14(19)17-13(8-9-24-3)15(20)23-2/h4-7,13H,8-10H2,1-3H3,(H,17,19)/t13-/m1/s1