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

Systemtic Name: N-[4-[1-(4-cyanophenyl)ethylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[1-(4-cyanophenyl)ethylcarbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[1-(4-cyanophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[1-(4-cyanophenyl)ethylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[1-(4-cyanophenyl)ethylthiocarbamoylamino]phenyl]coumarilamide Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C25H20N4O2S/c1-16(18-8-6-17(15-26)7-9-18)27-25(32)29-21-12-10-20(11-13-21)28-24(30)23-14-19-4-2-3-5-22(19)31-23/h2-14,16H,1H3,(H,28,30)(H2,27,29,32)