N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-(3-methoxypropyl)quinazoline-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-(3-methoxypropyl)quinazoline-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-(3-methoxypropyl)quinazoline-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-(3-methoxypropyl)quinazoline-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-(3-methoxypropyl)quinazoline-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-(3-methoxypropyl)amine Formula: C18H18ClFN4O MolecularWeight: 360.813123

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COCCCNC1=CC2=C(C=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H18ClFN4O/c1-25-8-2-7-21-12-4-6-17-14(9-12)18(23-11-22-17)24-13-3-5-16(20)15(19)10-13/h3-6,9-11,21H,2,7-8H2,1H3,(H,22,23,24)