N-[(E)-[3-methyl-2-(quinolin-8-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[3-methyl-2-(quinolin-8-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide Openeye Name: N-[(E)-[3-methyl-2-(8-quinolylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-4-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(8-quinolinylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(quinolin-8-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-4-carboxamide Traditional Name: N-[(E)-[3-methyl-2-(8-quinolylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]isonicotinamide Formula: C25H21N5O3 MolecularWeight: 439.46594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=NC=C3)CCC2)C(=O)NC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=NC=C3)/CCC2)C(=O)NC4=CC=CC5=C4N=CC=C5

InChI

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