N-[6-[2-[(2-chloranyl-6-methyl-phenyl)amino]benzimidazol-1-yl]pyrimidin-4-yl]morpholin-4-amine

Systemtic Name: N-[6-[2-[(2-chloranyl-6-methyl-phenyl)amino]benzimidazol-1-yl]pyrimidin-4-yl]morpholin-4-amine Openeye Name: N-[6-[2-(2-chloro-6-methyl-anilino)benzimidazol-1-yl]pyrimidin-4-yl]morpholin-4-amine CAS Name: N-[6-[2-(2-chloro-6-methylanilino)-1-benzimidazolyl]-4-pyrimidinyl]-4-morpholinamine IUPAC Name: N-[6-[2-(2-chloro-6-methylanilino)benzimidazol-1-yl]pyrimidin-4-yl]morpholin-4-amine Traditional Name: [6-[2-(2-chloro-6-methyl-anilino)benzimidazol-1-yl]pyrimidin-4-yl]-morpholino-amine Formula: C22H22ClN7O MolecularWeight: 435.90938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC2=NC3=CC=CC=C3N2C4=CC(=NC=N4)NN5CCOCC5

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC2=NC3=CC=CC=C3N2C4=CC(=NC=N4)NN5CCOCC5

InChI

InChI=1S/C22H22ClN7O/c1-15-5-4-6-16(23)21(15)27-22-26-17-7-2-3-8-18(17)30(22)20-13-19(24-14-25-20)28-29-9-11-31-12-10-29/h2-8,13-14H,9-12H2,1H3,(H,26,27)(H,24,25,28)