(2R)-3-[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: (2R)-3-[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: (2R)-3-(2-butyl-1,3-dioxo-isoindolin-5-yl)-2-(1-methylbenzimidazol-2-yl)-3-oxo-propanenitrile CAS Name: (2R)-3-(2-butyl-1,3-dioxo-5-isoindolyl)-2-(1-methyl-2-benzimidazolyl)-3-oxopropanenitrile IUPAC Name: (2R)-3-(2-butyl-1,3-dioxoisoindol-5-yl)-2-(1-methylbenzimidazol-2-yl)-3-oxopropanenitrile Traditional Name: (2R)-3-(2-butyl-1,3-diketo-isoindolin-5-yl)-3-keto-2-(1-methylbenzimidazol-2-yl)propionitrile Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)C(C#N)C3=NC4=CC=CC=C4N3C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)[C@H](C#N)C3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C23H20N4O3/c1-3-4-11-27-22(29)15-10-9-14(12-16(15)23(27)30)20(28)17(13-24)21-25-18-7-5-6-8-19(18)26(21)2/h5-10,12,17H,3-4,11H2,1-2H3/t17-/m0/s1