5-(4-chloranylphenoxy)-4-(4-methylpiperazin-1-yl)-N-phenyl-pyrimidin-2-amine

Systemtic Name: 5-(4-chloranylphenoxy)-4-(4-methylpiperazin-1-yl)-N-phenyl-pyrimidin-2-amine Openeye Name: 5-(4-chlorophenoxy)-4-(4-methylpiperazin-1-yl)-N-phenyl-pyrimidin-2-amine CAS Name: 5-(4-chlorophenoxy)-4-(4-methyl-1-piperazinyl)-N-phenyl-2-pyrimidinamine IUPAC Name: 5-(4-chlorophenoxy)-4-(4-methylpiperazin-1-yl)-N-phenylpyrimidin-2-amine Traditional Name: [5-(4-chlorophenoxy)-4-(4-methylpiperazino)pyrimidin-2-yl]-phenyl-amine Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)NC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)NC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN5O/c1-26-11-13-27(14-12-26)20-19(28-18-9-7-16(22)8-10-18)15-23-21(25-20)24-17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3,(H,23,24,25)