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

Systemtic Name: N-[4-[2-azanyl-6-(3-bromophenyl)pyrimidin-4-yl]phenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[2-amino-6-(3-bromophenyl)pyrimidin-4-yl]phenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[2-amino-6-(3-bromophenyl)-4-pyrimidinyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[2-amino-6-(3-bromophenyl)pyrimidin-4-yl]phenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[2-amino-6-(3-bromophenyl)pyrimidin-4-yl]phenyl]-(7-chloro-4-quinolyl)amine Formula: C25H17BrClN5 MolecularWeight: 502.79298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H17BrClN5/c26-17-3-1-2-16(12-17)23-14-22(31-25(28)32-23)15-4-7-19(8-5-15)30-21-10-11-29-24-13-18(27)6-9-20(21)24/h1-14H,(H,29,30)(H2,28,31,32)