7-[4-(dimethylamino)cyclohexyl]-6-methyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-[4-(dimethylamino)cyclohexyl]-6-methyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3-benzyloxyphenyl)-7-[4-(dimethylamino)cyclohexyl]-6-methyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-[4-(dimethylamino)cyclohexyl]-6-methyl-5-(3-phenylmethoxyphenyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-[4-(dimethylamino)cyclohexyl]-6-methyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [4-[4-amino-5-(3-benzoxyphenyl)-6-methyl-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]-dimethyl-amine Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3CCC(CC3)N(C)C)N=CN=C2N)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1C3CCC(CC3)N(C)C)N=CN=C2N)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H33N5O/c1-19-25(21-10-7-11-24(16-21)34-17-20-8-5-4-6-9-20)26-27(29)30-18-31-28(26)33(19)23-14-12-22(13-15-23)32(2)3/h4-11,16,18,22-23H,12-15,17H2,1-3H3,(H2,29,30,31)