cyclohexyl 4-[[2,3-bis(chloranyl)phenyl]carbonylcarbamothioylamino]benzoate

Systemtic Name: cyclohexyl 4-[[2,3-bis(chloranyl)phenyl]carbonylcarbamothioylamino]benzoate Openeye Name: cyclohexyl 4-[(2,3-dichlorobenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(2,3-dichlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[(2,3-dichlorobenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(2,3-dichlorobenzoyl)thiocarbamoylamino]benzoic acid cyclohexyl ester Formula: C21H20Cl2N2O3S MolecularWeight: 451.3661

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20Cl2N2O3S/c22-17-8-4-7-16(18(17)23)19(26)25-21(29)24-14-11-9-13(10-12-14)20(27)28-15-5-2-1-3-6-15/h4,7-12,15H,1-3,5-6H2,(H2,24,25,26,29)