[(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [(1R)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H26FNO3S MolecularWeight: 367.478043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)OC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)OC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C19H26FNO3S/c1-14(19(23)21-16-6-4-2-3-5-7-16)24-18(22)12-13-25-17-10-8-15(20)9-11-17/h8-11,14,16H,2-7,12-13H2,1H3,(H,21,23)/t14-/m1/s1