6-[(3-bromanyl-4-cyano-phenyl)amino]-4-cyclopropyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 6-[(3-bromanyl-4-cyano-phenyl)amino]-4-cyclopropyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide Openeye Name: 6-(3-bromo-4-cyano-anilino)-4-cyclopropyl-N-(tetrahydropyran-4-ylmethyl)pyridine-3-carboxamide CAS Name: 6-(3-bromo-4-cyanoanilino)-4-cyclopropyl-N-(4-oxanylmethyl)-3-pyridinecarboxamide IUPAC Name: 6-(3-bromo-4-cyanoanilino)-4-cyclopropyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide Traditional Name: 6-(3-bromo-4-cyano-anilino)-4-cyclopropyl-N-(tetrahydropyran-4-ylmethyl)nicotinamide Formula: C22H23BrN4O2 MolecularWeight: 455.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NC=C2C(=O)NCC3CCOCC3)NC4=CC(=C(C=C4)C#N)Br

Isomeric SMILES

C1CC1C2=CC(=NC=C2C(=O)NCC3CCOCC3)NC4=CC(=C(C=C4)C#N)Br

InChI

InChI=1S/C22H23BrN4O2/c23-20-9-17(4-3-16(20)11-24)27-21-10-18(15-1-2-15)19(13-25-21)22(28)26-12-14-5-7-29-8-6-14/h3-4,9-10,13-15H,1-2,5-8,12H2,(H,25,27)(H,26,28)