6-[(3-chloranyl-4-cyano-phenyl)amino]-N-(oxan-4-ylmethyl)-4-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: 6-[(3-chloranyl-4-cyano-phenyl)amino]-N-(oxan-4-ylmethyl)-4-propan-2-yl-pyridine-3-carboxamide Openeye Name: 6-(3-chloro-4-cyano-anilino)-4-isopropyl-N-(tetrahydropyran-4-ylmethyl)pyridine-3-carboxamide CAS Name: 6-(3-chloro-4-cyanoanilino)-N-(4-oxanylmethyl)-4-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 6-(3-chloro-4-cyanoanilino)-N-(oxan-4-ylmethyl)-4-propan-2-ylpyridine-3-carboxamide Traditional Name: 6-(3-chloro-4-cyano-anilino)-4-isopropyl-N-(tetrahydropyran-4-ylmethyl)nicotinamide Formula: C22H25ClN4O2 MolecularWeight: 412.9125

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC=C1C(=O)NCC2CCOCC2)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC(C)C1=CC(=NC=C1C(=O)NCC2CCOCC2)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C22H25ClN4O2/c1-14(2)18-10-21(27-17-4-3-16(11-24)20(23)9-17)25-13-19(18)22(28)26-12-15-5-7-29-8-6-15/h3-4,9-10,13-15H,5-8,12H2,1-2H3,(H,25,27)(H,26,28)