N-[4-[2-(3,4-dimethylphenoxy)ethanoylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[2-(3,4-dimethylphenoxy)ethanoylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[[2-(3,4-dimethylphenoxy)acetyl]carbamothioylamino]-2-methoxy-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[[2-(3,4-dimethylphenoxy)acetyl]carbamothioylamino]-2-methoxyphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[[2-(3,4-dimethylphenoxy)acetyl]thiocarbamoylamino]-2-methoxy-phenyl]coumarilamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC)C

InChI

InChI=1S/C27H25N3O5S/c1-16-8-10-20(12-17(16)2)34-15-25(31)30-27(36)28-19-9-11-21(23(14-19)33-3)29-26(32)24-13-18-6-4-5-7-22(18)35-24/h4-14H,15H2,1-3H3,(H,29,32)(H2,28,30,31,36)