N-[4-(1-benzofuran-2-ylcarbonylamino)-3-methyl-phenyl]-5-bromanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(1-benzofuran-2-ylcarbonylamino)-3-methyl-phenyl]-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]-5-bromo-pyridine-3-carboxamide CAS Name: N-[4-[[2-benzofuranyl(oxo)methyl]amino]-3-methylphenyl]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-[4-(1-benzofuran-2-carbonylamino)-3-methylphenyl]-5-bromopyridine-3-carboxamide Traditional Name: N-[4-(benzofuran-2-carbonylamino)-3-methyl-phenyl]-5-bromo-nicotinamide Formula: C22H16BrN3O3 MolecularWeight: 450.28474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H16BrN3O3/c1-13-8-17(25-21(27)15-9-16(23)12-24-11-15)6-7-18(13)26-22(28)20-10-14-4-2-3-5-19(14)29-20/h2-12H,1H3,(H,25,27)(H,26,28)