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

Systemtic Name: N-[(E)-[3-methyl-2-(2-thiophen-2-ylethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Openeye Name: N-[(E)-[3-methyl-2-[2-(2-thienyl)ethylcarbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinoline-2-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(2-thiophen-2-ylethylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-2-quinolinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(2-thiophen-2-ylethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Traditional Name: N-[(E)-[3-methyl-2-[2-(2-thienyl)ethylcarbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinaldamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=NC4=CC=CC=C4C=C3)CCC2)C(=O)NCCC5=CC=CS5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=NC4=CC=CC=C4C=C3)/CCC2)C(=O)NCCC5=CC=CS5

InChI

InChI=1S/C26H24N4O3S/c1-16-23-20(29-30-25(31)21-12-11-17-6-2-3-8-19(17)28-21)9-4-10-22(23)33-24(16)26(32)27-14-13-18-7-5-15-34-18/h2-3,5-8,11-12,15H,4,9-10,13-14H2,1H3,(H,27,32)(H,30,31)/b29-20+