N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[2-(methylsulfonylmethylamino)ethyl]furan-2-yl]quinazolin-4-amine

Systemtic Name: N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[2-(methylsulfonylmethylamino)ethyl]furan-2-yl]quinazolin-4-amine Openeye Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[2-(methylsulfonylmethylamino)ethyl]-2-furyl]quinazolin-4-amine CAS Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[2-(methylsulfonylmethylamino)ethyl]-2-furanyl]-4-quinazolinamine IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[2-(methylsulfonylmethylamino)ethyl]furan-2-yl]quinazolin-4-amine Traditional Name: 2-[5-[4-[3-chloro-4-(3-fluorobenzyl)oxy-anilino]quinazolin-6-yl]-2-furyl]ethyl-(mesylmethyl)amine Formula: C29H26ClFN4O4S MolecularWeight: 581.057543

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CNCCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl

Isomeric SMILES

CS(=O)(=O)CNCCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl

InChI

InChI=1S/C29H26ClFN4O4S/c1-40(36,37)18-32-12-11-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-17-33-26)35-22-6-9-28(25(30)15-22)38-16-19-3-2-4-21(31)13-19/h2-10,13-15,17,32H,11-12,16,18H2,1H3,(H,33,34,35)