N-[4-[2-(4-chloranylphenoxy)ethanoylcarbamothioylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[2-(4-chloranylphenoxy)ethanoylcarbamothioylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[[2-(4-chlorophenoxy)acetyl]carbamothioylamino]-2-methyl-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-2-methylphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[[2-(4-chlorophenoxy)acetyl]carbamothioylamino]-2-methylphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[[2-(4-chlorophenoxy)acetyl]thiocarbamoylamino]-2-methyl-phenyl]coumarilamide Formula: C25H20ClN3O4S MolecularWeight: 493.962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)Cl)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)Cl)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C25H20ClN3O4S/c1-15-12-18(27-25(34)29-23(30)14-32-19-9-6-17(26)7-10-19)8-11-20(15)28-24(31)22-13-16-4-2-3-5-21(16)33-22/h2-13H,14H2,1H3,(H,28,31)(H2,27,29,30,34)