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

Systemtic Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloranyl-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-2-one Openeye Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-2-one CAS Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxyphenoxy)-2-pyrimidinyl]-2-piperazinone IUPAC Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxyphenoxy)pyrimidin-2-yl]piperazin-2-one Traditional Name: 4-[4-(1H-benzimidazol-2-ylmethylamino)-6-(2-chloro-4-methoxy-phenoxy)pyrimidin-2-yl]piperazin-2-one Formula: C23H22ClN7O3 MolecularWeight: 479.91888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2=NC(=NC(=C2)NCC3=NC4=CC=CC=C4N3)N5CCNC(=O)C5)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC2=NC(=NC(=C2)NCC3=NC4=CC=CC=C4N3)N5CCNC(=O)C5)Cl

InChI

InChI=1S/C23H22ClN7O3/c1-33-14-6-7-18(15(24)10-14)34-22-11-19(29-23(30-22)31-9-8-25-21(32)13-31)26-12-20-27-16-4-2-3-5-17(16)28-20/h2-7,10-11H,8-9,12-13H2,1H3,(H,25,32)(H,27,28)(H,26,29,30)