6-(4-tert-butylphenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine hydrochloride

Systemtic Name: 6-(4-tert-butylphenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine hydrochloride Openeye Name: 6-(4-tert-butylphenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine hydrochloride CAS Name: 6-(4-tert-butylphenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine hydrochloride IUPAC Name: 6-(4-tert-butylphenyl)-4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine hydrochloride Traditional Name: [2-amino-6-(4-tert-butylphenyl)pyrimidin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine hydrochloride Formula: C22H25ClN4O2 MolecularWeight: 412.9125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)OCCO4.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)OCCO4.Cl

InChI

InChI=1S/C22H24N4O2.ClH/c1-22(2,3)15-6-4-14(5-7-15)17-13-20(26-21(23)25-17)24-16-8-9-18-19(12-16)28-11-10-27-18;/h4-9,12-13H,10-11H2,1-3H3,(H3,23,24,25,26);1H