3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C17H17BrN4O3 MolecularWeight: 405.24588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O3/c1-9-15(10(2)21(3)20-9)19-14(23)6-7-22-16(24)12-5-4-11(18)8-13(12)17(22)25/h4-5,8H,6-7H2,1-3H3,(H,19,23)