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

Systemtic Name: N-[(E)-[3-methyl-2-(pyridin-2-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Openeye Name: N-[(E)-[3-methyl-2-(2-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinoline-2-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(2-pyridinylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-2-quinolinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(pyridin-2-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]quinoline-2-carboxamide Traditional Name: N-[(E)-[3-methyl-2-(2-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]quinaldamide Formula: C25H21N5O3 MolecularWeight: 439.46594

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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)NC5=CC=CC=N5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=NC4=CC=CC=C4C=C3)/CCC2)C(=O)NC5=CC=CC=N5

InChI

InChI=1S/C25H21N5O3/c1-15-22-18(29-30-24(31)19-13-12-16-7-2-3-8-17(16)27-19)9-6-10-20(22)33-23(15)25(32)28-21-11-4-5-14-26-21/h2-5,7-8,11-14H,6,9-10H2,1H3,(H,30,31)(H,26,28,32)/b29-18+