N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-3-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-3-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-3-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-3-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]-3-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-3-methoxy-phenyl]-2-furamide Formula: C21H20ClN3O5S MolecularWeight: 461.9186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O5S/c1-27-17-11-19(29-3)15(10-13(17)22)25-21(31)24-14-7-6-12(9-18(14)28-2)23-20(26)16-5-4-8-30-16/h4-11H,1-3H3,(H,23,26)(H2,24,25,31)