ethyl 3-(cyclohexylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(cyclohexylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(cyclohexylcarbamothioylamino)benzoate CAS Name: 3-[[(cyclohexylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(cyclohexylcarbamothioylamino)benzoate Traditional Name: 3-(cyclohexylthiocarbamoylamino)benzoic acid ethyl ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O2S/c1-2-20-15(19)12-7-6-10-14(11-12)18-16(21)17-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H2,17,18,21)