5-bromanyl-N2-[4-(1-methylpiperidin-4-yl)oxyphenyl]-N4-phenyl-pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-[4-(1-methylpiperidin-4-yl)oxyphenyl]-N4-phenyl-pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-[4-[(1-methyl-4-piperidyl)oxy]phenyl]-N4-phenyl-pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-[4-[(1-methyl-4-piperidinyl)oxy]phenyl]-N4-phenylpyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]-4-N-phenylpyrimidine-2,4-diamine Traditional Name: (4-anilino-5-bromo-pyrimidin-2-yl)-[4-[(1-methyl-4-piperidyl)oxy]phenyl]amine Formula: C22H24BrN5O MolecularWeight: 454.36286

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4)Br

Isomeric SMILES

CN1CCC(CC1)OC2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4)Br

InChI

InChI=1S/C22H24BrN5O/c1-28-13-11-19(12-14-28)29-18-9-7-17(8-10-18)26-22-24-15-20(23)21(27-22)25-16-5-3-2-4-6-16/h2-10,15,19H,11-14H2,1H3,(H2,24,25,26,27)