5-bromanyl-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxo-ethylidene]isoindol-1-yl]furan-2-carboxamide CAS Name: 5-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1-isoindolyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]isoindol-1-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-keto-ethylidene]isoindol-1-yl]-2-furamide Formula: C22H19BrN4O3 MolecularWeight: 467.31526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(O4)Br)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)/C(=C\2/C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(O4)Br)/C#N

InChI

InChI=1S/C22H19BrN4O3/c23-18-11-10-17(30-18)22(29)27-20-15-9-5-4-8-14(15)19(26-20)16(12-24)21(28)25-13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7H2,(H,25,28)(H,26,27,29)/b19-16-