2-[[2-oxidanylidene-3-(phenylmethyl)-4-piperazin-1-yl-imidazo[4,5-c]pyridin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-oxidanylidene-3-(phenylmethyl)-4-piperazin-1-yl-imidazo[4,5-c]pyridin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[(3-benzyl-2-oxo-4-piperazin-1-yl-imidazo[4,5-c]pyridin-1-yl)methyl]benzonitrile CAS Name: 2-[[2-oxo-3-(phenylmethyl)-4-(1-piperazinyl)-1-imidazo[4,5-c]pyridinyl]methyl]benzonitrile IUPAC Name: 2-[(3-benzyl-2-oxo-4-piperazin-1-ylimidazo[4,5-c]pyridin-1-yl)methyl]benzonitrile Traditional Name: 2-[(3-benzyl-2-keto-4-piperazino-imidazo[4,5-c]pyridin-1-yl)methyl]benzonitrile Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC3=C2N(C(=O)N3CC4=CC=CC=C4C#N)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=NC=CC3=C2N(C(=O)N3CC4=CC=CC=C4C#N)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N6O/c26-16-20-8-4-5-9-21(20)18-30-22-10-11-28-24(29-14-12-27-13-15-29)23(22)31(25(30)32)17-19-6-2-1-3-7-19/h1-11,27H,12-15,17-18H2