N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-(4-pyridin-3-ylpyrimidin-2-yl)oxy-benzimidazole-1-carboxamide

Systemtic Name: N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-(4-pyridin-3-ylpyrimidin-2-yl)oxy-benzimidazole-1-carboxamide Openeye Name: N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-[4-(3-pyridyl)pyrimidin-2-yl]oxy-benzimidazole-1-carboxamide CAS Name: N-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-6-[[4-(3-pyridinyl)-2-pyrimidinyl]oxy]-1-benzimidazolecarboxamide IUPAC Name: N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-(4-pyridin-3-ylpyrimidin-2-yl)oxybenzimidazole-1-carboxamide Traditional Name: N-[4-[(4-methylpiperazino)methyl]phenyl]-6-[4-(3-pyridyl)pyrimidin-2-yl]oxy-benzimidazole-1-carboxamide Formula: C29H28N8O2 MolecularWeight: 520.58502

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)N3C=NC4=C3C=C(C=C4)OC5=NC=CC(=N5)C6=CN=CC=C6

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)N3C=NC4=C3C=C(C=C4)OC5=NC=CC(=N5)C6=CN=CC=C6

InChI

InChI=1S/C29H28N8O2/c1-35-13-15-36(16-14-35)19-21-4-6-23(7-5-21)33-29(38)37-20-32-26-9-8-24(17-27(26)37)39-28-31-12-10-25(34-28)22-3-2-11-30-18-22/h2-12,17-18,20H,13-16,19H2,1H3,(H,33,38)