[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-chlorophenyl)sulfanylethanoate

Systemtic Name: [1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-chlorophenyl)sulfanylethanoate Openeye Name: [2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-(2-chlorophenyl)sulfanylacetate CAS Name: 2-[(2-chlorophenyl)thio]acetic acid [1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(2-chlorophenyl)sulfanylacetate Traditional Name: 2-[(2-chlorophenyl)thio]acetic acid [2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22ClNO3S MolecularWeight: 355.87948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)CSC2=CC=CC=C2Cl

Isomeric SMILES

CC(C(=O)NC1CCCCC1)OC(=O)CSC2=CC=CC=C2Cl

InChI

InChI=1S/C17H22ClNO3S/c1-12(17(21)19-13-7-3-2-4-8-13)22-16(20)11-23-15-10-6-5-9-14(15)18/h5-6,9-10,12-13H,2-4,7-8,11H2,1H3,(H,19,21)