methyl 4-(cyclohexylcarbonylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(cyclohexylcarbonylcarbamothioylamino)benzoate Openeye Name: methyl 4-(cyclohexanecarbonylcarbamothioylamino)benzoate CAS Name: 4-[[[[cyclohexyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(cyclohexanecarbonylcarbamothioylamino)benzoate Traditional Name: 4-(cyclohexanecarbonylthiocarbamoylamino)benzoic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C16H20N2O3S/c1-21-15(20)12-7-9-13(10-8-12)17-16(22)18-14(19)11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H2,17,18,19,22)