4-[3-chloranyl-4-(oxan-4-ylamino)phenyl]-1-(2-cyclopropylethyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 4-[3-chloranyl-4-(oxan-4-ylamino)phenyl]-1-(2-cyclopropylethyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 4-[3-chloro-4-(tetrahydropyran-4-ylamino)phenyl]-1-(2-cyclopropylethyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 4-[3-chloro-4-(4-oxanylamino)phenyl]-1-(2-cyclopropylethyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 4-[3-chloro-4-(oxan-4-ylamino)phenyl]-1-(2-cyclopropylethyl)-2-oxopyridine-3-carbonitrile Traditional Name: 4-[3-chloro-4-(tetrahydropyran-4-ylamino)phenyl]-1-(2-cyclopropylethyl)-2-keto-nicotinonitrile Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCN2C=CC(=C(C2=O)C#N)C3=CC(=C(C=C3)NC4CCOCC4)Cl

Isomeric SMILES

C1CC1CCN2C=CC(=C(C2=O)C#N)C3=CC(=C(C=C3)NC4CCOCC4)Cl

InChI

InChI=1S/C22H24ClN3O2/c23-20-13-16(3-4-21(20)25-17-7-11-28-12-8-17)18-6-10-26(9-5-15-1-2-15)22(27)19(18)14-24/h3-4,6,10,13,15,17,25H,1-2,5,7-9,11-12H2