N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C23H22N4O2 MolecularWeight: 386.44638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N4O2/c1-15-22(17(3)27(25-15)18-9-5-4-6-10-18)24-21(28)13-14-26-16(2)19-11-7-8-12-20(19)23(26)29/h4-12H,2,13-14H2,1,3H3,(H,24,28)