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

Systemtic Name: 5-bromanyl-N-[(E)-[3-methyl-2-(3-methylbutylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(E)-[2-(isopentylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(E)-[3-methyl-2-[(3-methylbutylamino)-oxomethyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(E)-[3-methyl-2-(3-methylbutylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(E)-[2-(isoamylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C21H25BrN4O3 MolecularWeight: 461.3522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN4O3/c1-12(2)7-8-24-21(28)19-13(3)18-16(5-4-6-17(18)29-19)25-26-20(27)14-9-15(22)11-23-10-14/h9-12H,4-8H2,1-3H3,(H,24,28)(H,26,27)/b25-16+