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

Systemtic Name: N-[(E)-[2-(1,3-benzodioxol-5-ylcarbamoyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-[(E)-[2-(1,3-benzodioxol-5-ylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-5-bromo-pyridine-3-carboxamide CAS Name: N-[(E)-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-[(E)-[2-(1,3-benzodioxol-5-ylcarbamoyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-5-bromopyridine-3-carboxamide Traditional Name: N-[(E)-[2-(1,3-benzodioxol-5-ylcarbamoyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-5-bromo-nicotinamide Formula: C23H19BrN4O5 MolecularWeight: 511.32476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CN=C3)Br)CCC2)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CN=C3)Br)/CCC2)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H19BrN4O5/c1-12-20-16(27-28-22(29)13-7-14(24)10-25-9-13)3-2-4-18(20)33-21(12)23(30)26-15-5-6-17-19(8-15)32-11-31-17/h5-10H,2-4,11H2,1H3,(H,26,30)(H,28,29)/b27-16+