2-[4-[[2-butyl-4-oxidanylidene-5-(phenylmethyl)imidazo[4,5-c]pyridin-3-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[2-butyl-4-oxidanylidene-5-(phenylmethyl)imidazo[4,5-c]pyridin-3-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(5-benzyl-2-butyl-4-oxo-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[[2-butyl-4-oxo-5-(phenylmethyl)-3-imidazo[4,5-c]pyridinyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(5-benzyl-2-butyl-4-oxoimidazo[4,5-c]pyridin-3-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(5-benzyl-2-butyl-4-keto-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]benzonitrile Formula: C31H28N4O MolecularWeight: 472.58022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=O)N(C=C2)CC5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=O)N(C=C2)CC5=CC=CC=C5

InChI

InChI=1S/C31H28N4O/c1-2-3-13-29-33-28-18-19-34(21-23-9-5-4-6-10-23)31(36)30(28)35(29)22-24-14-16-25(17-15-24)27-12-8-7-11-26(27)20-32/h4-12,14-19H,2-3,13,21-22H2,1H3