N-[2-methoxy-4-[(3-propoxyphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-methoxy-4-[(3-propoxyphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methoxy-4-[(3-propoxybenzoyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[oxo-(3-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methoxy-4-[(3-propoxybenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methoxy-4-[(3-propoxybenzoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC

InChI

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