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

Systemtic Name: 5-bromanyl-N-[(E)-[3-methyl-2-(phenylazanylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: N-[(E)-[2-(anilinocarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-5-bromo-pyridine-3-carboxamide CAS Name: 5-bromo-N-[(E)-[3-methyl-2-[oxo-(phenylhydrazo)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[2-(anilinocarbamoyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-5-bromopyridine-3-carboxamide Traditional Name: N-[(E)-[2-(anilinocarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-5-bromo-nicotinamide Formula: C22H20BrN5O3 MolecularWeight: 482.3299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CN=C3)Br)CCC2)C(=O)NNC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CN=C3)Br)/CCC2)C(=O)NNC4=CC=CC=C4

InChI

InChI=1S/C22H20BrN5O3/c1-13-19-17(26-27-21(29)14-10-15(23)12-24-11-14)8-5-9-18(19)31-20(13)22(30)28-25-16-6-3-2-4-7-16/h2-4,6-7,10-12,25H,5,8-9H2,1H3,(H,27,29)(H,28,30)/b26-17+