2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propanamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[(1-methyl-2-imidazolyl)-phenylmethyl]propanamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]propanamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[(1-methylimidazol-2-yl)-phenyl-methyl]propionamide Formula: C22H19BrN4O3 MolecularWeight: 467.31526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=NC=CN2C)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=NC=CN2C)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O3/c1-13(27-21(29)16-9-8-15(23)12-17(16)22(27)30)20(28)25-18(14-6-4-3-5-7-14)19-24-10-11-26(19)2/h3-13,18H,1-2H3,(H,25,28)