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

Systemtic Name: N-[(E)-[3-methyl-2-(3-methylbutylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: N-[(E)-[2-(isopentylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: N-[(E)-[3-methyl-2-[(3-methylbutylamino)-oxomethyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[3-methyl-2-(3-methylbutylcarbamoyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: N-[(E)-[2-(isoamylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-13(2)9-11-23-21(27)19-14(3)18-16(7-4-8-17(18)28-19)24-25-20(26)15-6-5-10-22-12-15/h5-6,10,12-13H,4,7-9,11H2,1-3H3,(H,23,27)(H,25,26)/b24-16+