N-[4-[2-azanyl-6-(2,3,4-trimethoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine

Systemtic Name: N-[4-[2-azanyl-6-(2,3,4-trimethoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[2-amino-6-(2,3,4-trimethoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[2-amino-6-(2,3,4-trimethoxyphenyl)-4-pyrimidinyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[2-amino-6-(2,3,4-trimethoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[2-amino-6-(2,3,4-trimethoxyphenyl)pyrimidin-4-yl]phenyl]-(7-chloro-4-quinolyl)amine Formula: C28H24ClN5O3 MolecularWeight: 513.97486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NC(=NC(=C2)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NC(=NC(=C2)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl)N)OC)OC

InChI

InChI=1S/C28H24ClN5O3/c1-35-25-11-10-20(26(36-2)27(25)37-3)24-15-22(33-28(30)34-24)16-4-7-18(8-5-16)32-21-12-13-31-23-14-17(29)6-9-19(21)23/h4-15H,1-3H3,(H,31,32)(H2,30,33,34)