N-[2-methyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-methyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methyl-4-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methyl-4-[[(E)-3-phenylacryloyl]thiocarbamoylamino]phenyl]coumarilamide Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NC(=O)C=CC2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

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

InChI

InChI=1S/C26H21N3O3S/c1-17-15-20(27-26(33)29-24(30)14-11-18-7-3-2-4-8-18)12-13-21(17)28-25(31)23-16-19-9-5-6-10-22(19)32-23/h2-16H,1H3,(H,28,31)(H2,27,29,30,33)/b14-11+