ethyl 4-[(3,3,5-trimethylcyclohexyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(3,3,5-trimethylcyclohexyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(3,3,5-trimethylcyclohexyl)carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-[(3,3,5-trimethylcyclohexyl)amino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,3,5-trimethylcyclohexyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,3,5-trimethylcyclohexyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H28N2O2S MolecularWeight: 348.50282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CC(CC(C2)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CC(CC(C2)(C)C)C

InChI

InChI=1S/C19H28N2O2S/c1-5-23-17(22)14-6-8-15(9-7-14)20-18(24)21-16-10-13(2)11-19(3,4)12-16/h6-9,13,16H,5,10-12H2,1-4H3,(H2,20,21,24)