N-(2-aminophenyl)-4-[3-cyano-5-[(oxan-4-ylamino)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(oxan-4-ylamino)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[3-cyano-5-[(tetrahydropyran-4-ylamino)methyl]-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[(4-oxanylamino)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[(oxan-4-ylamino)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[3-cyano-5-[(tetrahydropyran-4-ylamino)methyl]-2-pyridyl]benzamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NCC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1COCCC1NCC2=CN=C(C(=C2)C#N)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C25H25N5O2/c26-14-20-13-17(15-28-21-9-11-32-12-10-21)16-29-24(20)18-5-7-19(8-6-18)25(31)30-23-4-2-1-3-22(23)27/h1-8,13,16,21,28H,9-12,15,27H2,(H,30,31)