ethyl 4-[(2,4-dichlorophenyl)methyl-(furan-2-ylcarbonylcarbamothioyl)amino]benzoate

Systemtic Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(furan-2-ylcarbonylcarbamothioyl)amino]benzoate Openeye Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(furan-2-carbonylcarbamothioyl)amino]benzoate CAS Name: 4-[(2,4-dichlorophenyl)methyl-[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(furan-2-carbonylcarbamothioyl)amino]benzoate Traditional Name: 4-[(2,4-dichlorobenzyl)-(2-furoylthiocarbamoyl)amino]benzoic acid ethyl ester Formula: C22H18Cl2N2O4S MolecularWeight: 477.36032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=C(C=C(C=C2)Cl)Cl)C(=S)NC(=O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=C(C=C(C=C2)Cl)Cl)C(=S)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H18Cl2N2O4S/c1-2-29-21(28)14-6-9-17(10-7-14)26(13-15-5-8-16(23)12-18(15)24)22(31)25-20(27)19-4-3-11-30-19/h3-12H,2,13H2,1H3,(H,25,27,31)