N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-cyclohexylphenoxy)ethanamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-cyclohexylphenoxy)ethanamide Openeye Name: 2-(4-cyclohexylphenoxy)-N-[(3,5-dichloro-4-hydroxy-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-cyclohexylphenoxy)-N-[(3,5-dichloro-4-hydroxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-cyclohexylphenoxy)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-cyclohexylphenoxy)-N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]acetamide Formula: C21H22Cl2N2O3S MolecularWeight: 453.38198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C21H22Cl2N2O3S/c22-17-10-15(11-18(23)20(17)27)24-21(29)25-19(26)12-28-16-8-6-14(7-9-16)13-4-2-1-3-5-13/h6-11,13,27H,1-5,12H2,(H2,24,25,26,29)