4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[2-(1-phenyl-4-pyrazolyl)ethyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]butanamide Traditional Name: N-[2-(1-phenylpyrazol-4-yl)ethyl]-4-phthalimido-butyramide Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N4O3/c28-21(11-6-14-26-22(29)19-9-4-5-10-20(19)23(26)30)24-13-12-17-15-25-27(16-17)18-7-2-1-3-8-18/h1-5,7-10,15-16H,6,11-14H2,(H,24,28)