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

Systemtic Name: 5-bromanyl-N-[(E)-[3-methyl-2-(pyridin-3-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(E)-[3-methyl-2-(3-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(E)-[3-methyl-2-[oxo-(3-pyridinylamino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(E)-[3-methyl-2-(pyridin-3-ylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(E)-[3-methyl-2-(3-pyridylcarbamoyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C21H18BrN5O3 MolecularWeight: 468.30332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CN=C3)Br)CCC2)C(=O)NC4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrN5O3/c1-12-18-16(26-27-20(28)13-8-14(22)10-24-9-13)5-2-6-17(18)30-19(12)21(29)25-15-4-3-7-23-11-15/h3-4,7-11H,2,5-6H2,1H3,(H,25,29)(H,27,28)/b26-16+