4-bromanyl-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide

Systemtic Name: 4-bromanyl-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide Openeye Name: 4-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxo-ethylidene]isoindol-1-yl]benzamide CAS Name: 4-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1-isoindolyl]benzamide IUPAC Name: 4-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]isoindol-1-yl]benzamide Traditional Name: 4-bromo-N-[(3Z)-3-[1-cyano-2-(cyclohexylamino)-2-keto-ethylidene]isoindol-1-yl]benzamide Formula: C24H21BrN4O2 MolecularWeight: 477.35314

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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(C=C4)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H21BrN4O2/c25-16-12-10-15(11-13-16)23(30)29-22-19-9-5-4-8-18(19)21(28-22)20(14-26)24(31)27-17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7H2,(H,27,31)(H,28,29,30)/b21-20-