methyl 3-(cyclohexylcarbamothioylamino)benzoate

Systemtic Name: methyl 3-(cyclohexylcarbamothioylamino)benzoate Openeye Name: methyl 3-(cyclohexylcarbamothioylamino)benzoate CAS Name: 3-[[(cyclohexylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-(cyclohexylcarbamothioylamino)benzoate Traditional Name: 3-(cyclohexylthiocarbamoylamino)benzoic acid methyl ester Formula: C15H20N2O2S MolecularWeight: 292.3965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=S)NC2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=S)NC2CCCCC2

InChI

InChI=1S/C15H20N2O2S/c1-19-14(18)11-6-5-9-13(10-11)17-15(20)16-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H2,16,17,20)