(2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)isoindol-1-ylidene]ethanenitrile

Systemtic Name: (2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)isoindol-1-ylidene]ethanenitrile Openeye Name: (2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)isoindol-1-ylidene]acetonitrile CAS Name: (2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)-1-isoindolylidene]acetonitrile IUPAC Name: (2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)isoindol-1-ylidene]acetonitrile Traditional Name: (2Z)-2-(1H-benzimidazol-2-yl)-2-[3-(butylamino)isoindol-1-ylidene]acetonitrile Formula: C21H19N5 MolecularWeight: 341.40906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=C(C#N)C2=NC3=CC=CC=C3N2)C4=CC=CC=C41

Isomeric SMILES

CCCCNC1=N/C(=C(/C#N)\C2=NC3=CC=CC=C3N2)/C4=CC=CC=C41

InChI

InChI=1S/C21H19N5/c1-2-3-12-23-20-15-9-5-4-8-14(15)19(26-20)16(13-22)21-24-17-10-6-7-11-18(17)25-21/h4-11H,2-3,12H2,1H3,(H,23,26)(H,24,25)/b19-16-