3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H22N4O2/c1-17-20-5-2-3-6-21(20)23(29)26(17)16-12-22(28)24-14-11-18-7-9-19(10-8-18)27-15-4-13-25-27/h2-10,13,15H,1,11-12,14,16H2,(H,24,28)