4-chloranyl-2-fluoranyl-N-[[7-(3-morpholin-4-ylpropylsulfanyl)quinazolin-4-yl]oxymethyl]aniline

Systemtic Name: 4-chloranyl-2-fluoranyl-N-[[7-(3-morpholin-4-ylpropylsulfanyl)quinazolin-4-yl]oxymethyl]aniline Openeye Name: 4-chloro-2-fluoro-N-[[7-(3-morpholinopropylsulfanyl)quinazolin-4-yl]oxymethyl]aniline CAS Name: 4-chloro-2-fluoro-N-[[7-[3-(4-morpholinyl)propylthio]-4-quinazolinyl]oxymethyl]aniline IUPAC Name: 4-chloro-2-fluoro-N-[[7-(3-morpholin-4-ylpropylsulfanyl)quinazolin-4-yl]oxymethyl]aniline Traditional Name: (4-chloro-2-fluoro-phenyl)-[[7-(3-morpholinopropylthio)quinazolin-4-yl]oxymethyl]amine Formula: C22H24ClFN4O2S MolecularWeight: 462.967963

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCSC2=CC3=C(C=C2)C(=NC=N3)OCNC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

C1COCCN1CCCSC2=CC3=C(C=C2)C(=NC=N3)OCNC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C22H24ClFN4O2S/c23-16-2-5-20(19(24)12-16)27-15-30-22-18-4-3-17(13-21(18)25-14-26-22)31-11-1-6-28-7-9-29-10-8-28/h2-5,12-14,27H,1,6-11,15H2