butyl 2-chloranyl-5-[(3-chloranyl-4-methoxy-phenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: butyl 2-chloranyl-5-[(3-chloranyl-4-methoxy-phenyl)carbonylcarbamothioylamino]benzoate Openeye Name: butyl 2-chloro-5-[(3-chloro-4-methoxy-benzoyl)carbamothioylamino]benzoate CAS Name: 2-chloro-5-[[[[(3-chloro-4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-chloro-5-[(3-chloro-4-methoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 2-chloro-5-[(3-chloro-4-methoxy-benzoyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C20H20Cl2N2O4S MolecularWeight: 455.3548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20Cl2N2O4S/c1-3-4-9-28-19(26)14-11-13(6-7-15(14)21)23-20(29)24-18(25)12-5-8-17(27-2)16(22)10-12/h5-8,10-11H,3-4,9H2,1-2H3,(H2,23,24,25,29)