N-[(E)-[3-methyl-2-(2-thiophen-2-ylethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[3-methyl-2-(2-thiophen-2-ylethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide Openeye Name: N-[(E)-[3-methyl-2-[2-(2-thienyl)ethylcarbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-4-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(2-thiophen-2-ylethylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(2-thiophen-2-ylethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide Traditional Name: N-[(E)-[3-methyl-2-[2-(2-thienyl)ethylcarbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]isonicotinamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=NC=C3)CCC2)C(=O)NCCC4=CC=CS4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=NC=C3)/CCC2)C(=O)NCCC4=CC=CS4

InChI

InChI=1S/C22H22N4O3S/c1-14-19-17(25-26-21(27)15-7-10-23-11-8-15)5-2-6-18(19)29-20(14)22(28)24-12-9-16-4-3-13-30-16/h3-4,7-8,10-11,13H,2,5-6,9,12H2,1H3,(H,24,28)(H,26,27)/b25-17+