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

Systemtic Name: N-[4-[2-azanyl-6-(4-methoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[2-amino-6-(4-methoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[2-amino-6-(4-methoxyphenyl)-4-pyrimidinyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[2-amino-6-(4-methoxyphenyl)pyrimidin-4-yl]phenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[2-amino-6-(4-methoxyphenyl)pyrimidin-4-yl]phenyl]-(7-chloro-4-quinolyl)amine Formula: C26H20ClN5O MolecularWeight: 453.9229

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H20ClN5O/c1-33-20-9-4-17(5-10-20)24-15-23(31-26(28)32-24)16-2-7-19(8-3-16)30-22-12-13-29-25-14-18(27)6-11-21(22)25/h2-15H,1H3,(H,29,30)(H2,28,31,32)