N-[4-[1-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[1-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[1-(benzofuran-2-yl)ethylcarbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[1-(2-benzofuranyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[1-(1-benzofuran-2-yl)ethylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[1-(benzofuran-2-yl)ethylthiocarbamoylamino]phenyl]coumarilamide Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C26H21N3O3S/c1-16(23-14-17-6-2-4-8-21(17)31-23)27-26(33)29-20-12-10-19(11-13-20)28-25(30)24-15-18-7-3-5-9-22(18)32-24/h2-16H,1H3,(H,28,30)(H2,27,29,33)