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

Systemtic Name: N-[(E)-[3-methyl-2-(pyridin-4-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: N-[(E)-[3-methyl-2-(4-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: N-[(E)-[3-methyl-2-[oxo-(pyridin-4-ylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(pyridin-4-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: N-[(E)-[3-methyl-2-(4-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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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=NC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CN=CC=C3)/CCC2)C(=O)NC4=CC=NC=C4

InChI

InChI=1S/C21H19N5O3/c1-13-18-16(25-26-20(27)14-4-3-9-23-12-14)5-2-6-17(18)29-19(13)21(28)24-15-7-10-22-11-8-15/h3-4,7-12H,2,5-6H2,1H3,(H,26,27)(H,22,24,28)/b25-16+