5-[[3-(4-tert-butylphenyl)-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3-(4-tert-butylphenyl)-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3-(4-tert-butylphenyl)-4,5-dimethoxy-phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3-(4-tert-butylphenyl)-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3-(4-tert-butylphenyl)-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-(4-tert-butylphenyl)-4,5-dimethoxy-benzyl]pyrimidin-4-yl]amine Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=CC(=C2OC)OC)CC3=CN=C(N=C3N)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=CC(=C2OC)OC)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C23H28N4O2/c1-23(2,3)17-8-6-15(7-9-17)18-11-14(12-19(28-4)20(18)29-5)10-16-13-26-22(25)27-21(16)24/h6-9,11-13H,10H2,1-5H3,(H4,24,25,26,27)