butyl 4-[[3,5-bis(chloranyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: butyl 4-[[3,5-bis(chloranyl)phenyl]carbamothioylamino]benzoate Openeye Name: butyl 4-[(3,5-dichlorophenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3,5-dichloroanilino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3,5-dichlorophenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,5-dichlorophenyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C18H18Cl2N2O2S MolecularWeight: 397.31872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C18H18Cl2N2O2S/c1-2-3-8-24-17(23)12-4-6-15(7-5-12)21-18(25)22-16-10-13(19)9-14(20)11-16/h4-7,9-11H,2-3,8H2,1H3,(H2,21,22,25)