N-(2-chloranyl-5-methoxy-phenyl)-6-[3-(4-methylpiperazin-1-yl)propoxy]-5-(oxan-4-yloxy)quinazolin-4-amine

Systemtic Name: N-(2-chloranyl-5-methoxy-phenyl)-6-[3-(4-methylpiperazin-1-yl)propoxy]-5-(oxan-4-yloxy)quinazolin-4-amine Openeye Name: N-(2-chloro-5-methoxy-phenyl)-6-[3-(4-methylpiperazin-1-yl)propoxy]-5-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(2-chloro-5-methoxyphenyl)-6-[3-(4-methyl-1-piperazinyl)propoxy]-5-(4-oxanyloxy)-4-quinazolinamine IUPAC Name: N-(2-chloro-5-methoxyphenyl)-6-[3-(4-methylpiperazin-1-yl)propoxy]-5-(oxan-4-yloxy)quinazolin-4-amine Traditional Name: (2-chloro-5-methoxy-phenyl)-[6-[3-(4-methylpiperazino)propoxy]-5-tetrahydropyran-4-yloxy-quinazolin-4-yl]amine Formula: C28H36ClN5O4 MolecularWeight: 542.06954

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=C(C3=C(C=C2)N=CN=C3NC4=C(C=CC(=C4)OC)Cl)OC5CCOCC5

Isomeric SMILES

CN1CCN(CC1)CCCOC2=C(C3=C(C=C2)N=CN=C3NC4=C(C=CC(=C4)OC)Cl)OC5CCOCC5

InChI

InChI=1S/C28H36ClN5O4/c1-33-11-13-34(14-12-33)10-3-15-37-25-7-6-23-26(27(25)38-20-8-16-36-17-9-20)28(31-19-30-23)32-24-18-21(35-2)4-5-22(24)29/h4-7,18-20H,3,8-17H2,1-2H3,(H,30,31,32)