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

Systemtic Name: N-[(E)-[3-methyl-2-(pyridin-3-ylmethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Openeye Name: N-[(E)-[3-methyl-2-(3-pyridylmethylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinoline-2-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(3-pyridinylmethylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-2-quinolinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(pyridin-3-ylmethylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Traditional Name: N-[(E)-[3-methyl-2-(3-pyridylmethylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinaldamide Formula: C26H23N5O3 MolecularWeight: 453.49252

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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)NCC5=CN=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=NC4=CC=CC=C4C=C3)/CCC2)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C26H23N5O3/c1-16-23-20(30-31-25(32)21-12-11-18-7-2-3-8-19(18)29-21)9-4-10-22(23)34-24(16)26(33)28-15-17-6-5-13-27-14-17/h2-3,5-8,11-14H,4,9-10,15H2,1H3,(H,28,33)(H,31,32)/b30-20+