N-(3-chloranyl-4-methoxy-phenyl)-4-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidin-2-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidin-2-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-4-(4-methylpiperazin-1-yl)-6-phenyl-pyrimidin-2-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-4-(4-methyl-1-piperazinyl)-6-phenyl-2-pyrimidinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-6-phenylpyrimidin-2-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[4-(4-methylpiperazino)-6-phenyl-pyrimidin-2-yl]amine Formula: C22H24ClN5O MolecularWeight: 409.91186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN5O/c1-27-10-12-28(13-11-27)21-15-19(16-6-4-3-5-7-16)25-22(26-21)24-17-8-9-20(29-2)18(23)14-17/h3-9,14-15H,10-13H2,1-2H3,(H,24,25,26)