3-[[2-(benzimidazol-1-yl)-6-(morpholin-4-ylamino)pyrimidin-4-yl]amino]-4-methyl-phenol

Systemtic Name: 3-[[2-(benzimidazol-1-yl)-6-(morpholin-4-ylamino)pyrimidin-4-yl]amino]-4-methyl-phenol Openeye Name: 3-[[2-(benzimidazol-1-yl)-6-(morpholinoamino)pyrimidin-4-yl]amino]-4-methyl-phenol CAS Name: 3-[[2-(1-benzimidazolyl)-6-(4-morpholinylamino)-4-pyrimidinyl]amino]-4-methylphenol IUPAC Name: 3-[[2-(benzimidazol-1-yl)-6-(morpholin-4-ylamino)pyrimidin-4-yl]amino]-4-methylphenol Traditional Name: 3-[[2-(benzimidazol-1-yl)-6-(morpholinoamino)pyrimidin-4-yl]amino]-4-methyl-phenol Formula: C22H23N7O2 MolecularWeight: 417.46372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)O)NC2=CC(=NC(=N2)N3C=NC4=CC=CC=C43)NN5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)O)NC2=CC(=NC(=N2)N3C=NC4=CC=CC=C43)NN5CCOCC5

InChI

InChI=1S/C22H23N7O2/c1-15-6-7-16(30)12-18(15)24-20-13-21(27-28-8-10-31-11-9-28)26-22(25-20)29-14-23-17-4-2-3-5-19(17)29/h2-7,12-14,30H,8-11H2,1H3,(H2,24,25,26,27)