ethyl 4-(cycloheptylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(cycloheptylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(cycloheptylcarbamothioylamino)benzoate CAS Name: 4-[[(cycloheptylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(cycloheptylcarbamothioylamino)benzoate Traditional Name: 4-(cycloheptylthiocarbamoylamino)benzoic acid ethyl ester Formula: C17H24N2O2S MolecularWeight: 320.44966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CCCCCC2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CCCCCC2

InChI

InChI=1S/C17H24N2O2S/c1-2-21-16(20)13-9-11-15(12-10-13)19-17(22)18-14-7-5-3-4-6-8-14/h9-12,14H,2-8H2,1H3,(H2,18,19,22)