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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CN=CC=C3)CCC2)C(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CN=CC=C3)/CCC2)C(=O)NC4=CC=CC5=C4C=CC=N5

InChI

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