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

Systemtic Name: 5-bromanyl-N-[(E)-[3-methyl-2-[(4-phenyldiazenylphenyl)carbamoyl]-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(E)-[3-methyl-2-[(4-phenylazophenyl)carbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(E)-[3-methyl-2-[oxo-(4-phenyldiazenylanilino)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(E)-[3-methyl-2-[(4-phenyldiazenylphenyl)carbamoyl]-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(E)-[3-methyl-2-[(4-phenylazophenyl)carbamoyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]nicotinamide Formula: C28H23BrN6O3 MolecularWeight: 571.42462

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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=CC=C(C=C4)N=NC5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CN=C3)Br)/CCC2)C(=O)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

InChI

InChI=1S/C28H23BrN6O3/c1-17-25-23(34-35-27(36)18-14-19(29)16-30-15-18)8-5-9-24(25)38-26(17)28(37)31-20-10-12-22(13-11-20)33-32-21-6-3-2-4-7-21/h2-4,6-7,10-16H,5,8-9H2,1H3,(H,31,37)(H,35,36)/b33-32?,34-23+