4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-(2-morpholin-4-ylethylamino)quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-(2-morpholin-4-ylethylamino)quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-(2-morpholinoethylamino)quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-6-[2-(4-morpholinyl)ethylamino]-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-(2-morpholin-4-ylethylamino)quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-(2-morpholinoethylamino)quinoline-3-carbonitrile Formula: C22H21ClFN5O MolecularWeight: 425.886443

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1COCCN1CCNC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H21ClFN5O/c23-19-12-17(1-3-20(19)24)28-22-15(13-25)14-27-21-4-2-16(11-18(21)22)26-5-6-29-7-9-30-10-8-29/h1-4,11-12,14,26H,5-10H2,(H,27,28)