1-[4-(2,2-dimethylmorpholin-4-yl)-6-morpholin-4-yl-pyrimidin-2-yl]benzimidazole-2,4-diamine

Systemtic Name: 1-[4-(2,2-dimethylmorpholin-4-yl)-6-morpholin-4-yl-pyrimidin-2-yl]benzimidazole-2,4-diamine Openeye Name: 1-[4-(2,2-dimethylmorpholin-4-yl)-6-morpholino-pyrimidin-2-yl]benzimidazole-2,4-diamine CAS Name: 1-[4-(2,2-dimethyl-4-morpholinyl)-6-(4-morpholinyl)-2-pyrimidinyl]benzimidazole-2,4-diamine IUPAC Name: 1-[4-(2,2-dimethylmorpholin-4-yl)-6-morpholin-4-ylpyrimidin-2-yl]benzimidazole-2,4-diamine Traditional Name: [2-amino-1-[4-(2,2-dimethylmorpholino)-6-morpholino-pyrimidin-2-yl]benzimidazol-4-yl]amine Formula: C21H28N8O2 MolecularWeight: 424.49942

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCO1)C2=NC(=NC(=C2)N3CCOCC3)N4C5=C(C(=CC=C5)N)N=C4N)C

Isomeric SMILES

CC1(CN(CCO1)C2=NC(=NC(=C2)N3CCOCC3)N4C5=C(C(=CC=C5)N)N=C4N)C

InChI

InChI=1S/C21H28N8O2/c1-21(2)13-28(8-11-31-21)17-12-16(27-6-9-30-10-7-27)24-20(25-17)29-15-5-3-4-14(22)18(15)26-19(29)23/h3-5,12H,6-11,13,22H2,1-2H3,(H2,23,26)