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

Systemtic Name: 5-bromanyl-N-[(E)-[3-methyl-2-[(3-methylpyridin-2-yl)carbamoyl]-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(E)-[3-methyl-2-[(3-methyl-2-pyridyl)carbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(E)-[3-methyl-2-[[(3-methyl-2-pyridinyl)amino]-oxomethyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(E)-[3-methyl-2-[(3-methylpyridin-2-yl)carbamoyl]-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(E)-[3-methyl-2-[(3-methyl-2-pyridyl)carbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C22H20BrN5O3 MolecularWeight: 482.3299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)C2=C(C3=C(O2)CCCC3=NNC(=O)C4=CC(=CN=C4)Br)C

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)C2=C(C\3=C(O2)CCC/C3=N\NC(=O)C4=CC(=CN=C4)Br)C

InChI

InChI=1S/C22H20BrN5O3/c1-12-5-4-8-25-20(12)26-22(30)19-13(2)18-16(6-3-7-17(18)31-19)27-28-21(29)14-9-15(23)11-24-10-14/h4-5,8-11H,3,6-7H2,1-2H3,(H,28,29)(H,25,26,30)/b27-16+