1-[2-[[3,4-dimethoxy-5-(2-morpholin-4-ylethoxy)phenyl]amino]pyrimidin-4-yl]benzimidazol-2-amine

Systemtic Name: 1-[2-[[3,4-dimethoxy-5-(2-morpholin-4-ylethoxy)phenyl]amino]pyrimidin-4-yl]benzimidazol-2-amine Openeye Name: 1-[2-[3,4-dimethoxy-5-(2-morpholinoethoxy)anilino]pyrimidin-4-yl]benzimidazol-2-amine CAS Name: 1-[2-[3,4-dimethoxy-5-[2-(4-morpholinyl)ethoxy]anilino]-4-pyrimidinyl]-2-benzimidazolamine IUPAC Name: 1-[2-[3,4-dimethoxy-5-(2-morpholin-4-ylethoxy)anilino]pyrimidin-4-yl]benzimidazol-2-amine Traditional Name: [4-(2-aminobenzimidazol-1-yl)pyrimidin-2-yl]-[3,4-dimethoxy-5-(2-morpholinoethoxy)phenyl]amine Formula: C25H29N7O4 MolecularWeight: 491.54226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)NC2=NC=CC(=N2)N3C4=CC=CC=C4N=C3N)OCCN5CCOCC5)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)NC2=NC=CC(=N2)N3C4=CC=CC=C4N=C3N)OCCN5CCOCC5)OC

InChI

InChI=1S/C25H29N7O4/c1-33-20-15-17(16-21(23(20)34-2)36-14-11-31-9-12-35-13-10-31)28-25-27-8-7-22(30-25)32-19-6-4-3-5-18(19)29-24(32)26/h3-8,15-16H,9-14H2,1-2H3,(H2,26,29)(H,27,28,30)