[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C16H21NO3S MolecularWeight: 307.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)OCC(=O)NC2CCCCC2

Isomeric SMILES

CSC1=CC=CC=C1C(=O)OCC(=O)NC2CCCCC2

InChI

InChI=1S/C16H21NO3S/c1-21-14-10-6-5-9-13(14)16(19)20-11-15(18)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3,(H,17,18)