1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloranyl-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloranyl-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxyphenoxy)-2-pyrimidinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxyphenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxy-phenoxy)pyrimidin-2-yl]piperazino]ethanone Formula: C25H26ClN7O3 MolecularWeight: 507.97204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=CC(=N2)OC3=C(C=C(C=C3)OC)Cl)NCC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=CC(=N2)OC3=C(C=C(C=C3)OC)Cl)NCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H26ClN7O3/c1-16(34)32-9-11-33(12-10-32)25-30-22(27-15-23-28-19-5-3-4-6-20(19)29-23)14-24(31-25)36-21-8-7-17(35-2)13-18(21)26/h3-8,13-14H,9-12,15H2,1-2H3,(H,28,29)(H,27,30,31)