1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]benzimidazole-2-carbonitrile

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]benzimidazole-2-carbonitrile Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]benzimidazole-2-carbonitrile CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-benzimidazolecarbonitrile IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]benzimidazole-2-carbonitrile Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]benzimidazole-2-carbonitrile Formula: C19H16N4O MolecularWeight: 316.35654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=CC=CC=C4N=C3C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=CC=CC=C4N=C3C#N

InChI

InChI=1S/C19H16N4O/c20-11-18-21-16-7-3-4-8-17(16)23(18)13-19(24)22-10-9-14-5-1-2-6-15(14)12-22/h1-8H,9-10,12-13H2