N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2-(phenylcarbonyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2-(phenylcarbonyl)phenyl]furan-2-carboxamide Openeye Name: N-[2-benzoyl-4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[2-benzoyl-4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-benzoyl-4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[2-benzoyl-4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C27H22ClN3O5S MolecularWeight: 535.99868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)C(=O)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)C(=O)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C27H22ClN3O5S/c1-34-23-15-24(35-2)21(14-19(23)28)31-27(37)29-17-10-11-20(30-26(33)22-9-6-12-36-22)18(13-17)25(32)16-7-4-3-5-8-16/h3-15H,1-2H3,(H,30,33)(H2,29,31,37)