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

Systemtic Name: 5-(4-chloranylphenoxy)-4-(4-methylpiperazin-1-yl)-N-(phenylmethyl)pyrimidin-2-amine Openeye Name: N-benzyl-5-(4-chlorophenoxy)-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine CAS Name: 5-(4-chlorophenoxy)-4-(4-methyl-1-piperazinyl)-N-(phenylmethyl)-2-pyrimidinamine IUPAC Name: N-benzyl-5-(4-chlorophenoxy)-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: benzyl-[5-(4-chlorophenoxy)-4-(4-methylpiperazino)pyrimidin-2-yl]amine Formula: C22H24ClN5O MolecularWeight: 409.91186

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)NCC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC=C2OC3=CC=C(C=C3)Cl)NCC4=CC=CC=C4

InChI

InChI=1S/C22H24ClN5O/c1-27-11-13-28(14-12-27)21-20(29-19-9-7-18(23)8-10-19)16-25-22(26-21)24-15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,24,25,26)