N-(2-aminophenyl)-4-[3-cyano-5-(piperazin-1-ylmethyl)pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-(piperazin-1-ylmethyl)pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-(piperazin-1-ylmethyl)-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-(1-piperazinylmethyl)-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-(piperazin-1-ylmethyl)pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-(piperazinomethyl)-2-pyridyl]benzamide Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1CN(CCN1)CC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C24H24N6O/c25-14-20-13-17(16-30-11-9-27-10-12-30)15-28-23(20)18-5-7-19(8-6-18)24(31)29-22-4-2-1-3-21(22)26/h1-8,13,15,27H,9-12,16,26H2,(H,29,31)