N4-[4-(4-azanyl-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3-methoxy-phenyl]-N1-methyl-benzene-1,4-diamine

Systemtic Name: N4-[4-(4-azanyl-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3-methoxy-phenyl]-N1-methyl-benzene-1,4-diamine Openeye Name: N4-[4-(4-amino-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3-methoxy-phenyl]-N1-methyl-benzene-1,4-diamine CAS Name: N4-[4-(4-amino-7-tert-butyl-5-pyrrolo[2,3-d]pyrimidinyl)-3-methoxyphenyl]-N1-methylbenzene-1,4-diamine IUPAC Name: 4-N-[4-(4-amino-7-tert-butylpyrrolo[2,3-d]pyrimidin-5-yl)-3-methoxyphenyl]-1-N-methylbenzene-1,4-diamine Traditional Name: [4-[4-(4-amino-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3-methoxy-anilino]phenyl]-methyl-amine Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C2=C1N=CN=C2N)C3=C(C=C(C=C3)NC4=CC=C(C=C4)NC)OC

Isomeric SMILES

CC(C)(C)N1C=C(C2=C1N=CN=C2N)C3=C(C=C(C=C3)NC4=CC=C(C=C4)NC)OC

InChI

InChI=1S/C24H28N6O/c1-24(2,3)30-13-19(21-22(25)27-14-28-23(21)30)18-11-10-17(12-20(18)31-5)29-16-8-6-15(26-4)7-9-16/h6-14,26,29H,1-5H3,(H2,25,27,28)