4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(imidazol-1-ylmethyl)phenyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[3-(1-imidazolylmethyl)phenyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]butanamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-4-phthalimido-butyramide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C22H20N4O3/c27-20(24-17-6-3-5-16(13-17)14-25-12-10-23-15-25)9-4-11-26-21(28)18-7-1-2-8-19(18)22(26)29/h1-3,5-8,10,12-13,15H,4,9,11,14H2,(H,24,27)