4-[5-fluoranyl-2-[(2-oxidanylidene-1-propan-2-yl-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile

Systemtic Name: 4-[5-fluoranyl-2-[(2-oxidanylidene-1-propan-2-yl-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile Openeye Name: 4-[5-fluoro-2-[(1-isopropyl-2-oxo-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile CAS Name: 4-[5-fluoro-2-[(2-oxo-1-propan-2-yl-3-imidazo[4,5-c]pyridinyl)methyl]-1-benzimidazolyl]butanenitrile IUPAC Name: 4-[5-fluoro-2-[(2-oxo-1-propan-2-ylimidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butanenitrile Traditional Name: 4-[5-fluoro-2-[(1-isopropyl-2-keto-imidazo[4,5-c]pyridin-3-yl)methyl]benzimidazol-1-yl]butyronitrile Formula: C21H21FN6O MolecularWeight: 392.429443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=NC=C2)N(C1=O)CC3=NC4=C(N3CCCC#N)C=CC(=C4)F

Isomeric SMILES

CC(C)N1C2=C(C=NC=C2)N(C1=O)CC3=NC4=C(N3CCCC#N)C=CC(=C4)F

InChI

InChI=1S/C21H21FN6O/c1-14(2)28-18-7-9-24-12-19(18)27(21(28)29)13-20-25-16-11-15(22)5-6-17(16)26(20)10-4-3-8-23/h5-7,9,11-12,14H,3-4,10,13H2,1-2H3