2-[[5-[4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]furan-2-yl]methylamino]ethanesulfonamide

Systemtic Name: 2-[[5-[4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]furan-2-yl]methylamino]ethanesulfonamide Openeye Name: 2-[[5-[4-(4-benzyloxyanilino)quinazolin-6-yl]-2-furyl]methylamino]ethanesulfonamide CAS Name: 2-[[5-[4-(4-phenylmethoxyanilino)-6-quinazolinyl]-2-furanyl]methylamino]ethanesulfonamide IUPAC Name: 2-[[5-[4-(4-phenylmethoxyanilino)quinazolin-6-yl]furan-2-yl]methylamino]ethanesulfonamide Traditional Name: 2-[[5-[4-(4-benzoxyanilino)quinazolin-6-yl]-2-furyl]methylamino]ethanesulfonamide Formula: C28H27N5O4S MolecularWeight: 529.61008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C5=CC=C(O5)CNCCS(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C5=CC=C(O5)CNCCS(=O)(=O)N

InChI

InChI=1S/C28H27N5O4S/c29-38(34,35)15-14-30-17-24-11-13-27(37-24)21-6-12-26-25(16-21)28(32-19-31-26)33-22-7-9-23(10-8-22)36-18-20-4-2-1-3-5-20/h1-13,16,19,30H,14-15,17-18H2,(H2,29,34,35)(H,31,32,33)