7-[3-(azetidin-1-yl)propoxy]-N4-(3-chloranyl-4-fluoranyl-phenyl)quinazoline-4,6-diamine

Systemtic Name: 7-[3-(azetidin-1-yl)propoxy]-N4-(3-chloranyl-4-fluoranyl-phenyl)quinazoline-4,6-diamine Openeye Name: 7-[3-(azetidin-1-yl)propoxy]-N4-(3-chloro-4-fluoro-phenyl)quinazoline-4,6-diamine CAS Name: 7-[3-(1-azetidinyl)propoxy]-N4-(3-chloro-4-fluorophenyl)quinazoline-4,6-diamine IUPAC Name: 7-[3-(azetidin-1-yl)propoxy]-4-N-(3-chloro-4-fluorophenyl)quinazoline-4,6-diamine Traditional Name: [6-amino-7-[3-(azetidin-1-yl)propoxy]quinazolin-4-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C20H21ClFN5O MolecularWeight: 401.865043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

Isomeric SMILES

C1CN(C1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)N

InChI

InChI=1S/C20H21ClFN5O/c21-15-9-13(3-4-16(15)22)26-20-14-10-17(23)19(11-18(14)24-12-25-20)28-8-2-7-27-5-1-6-27/h3-4,9-12H,1-2,5-8,23H2,(H,24,25,26)