N6-(4-ethylphenyl)-N4-(4-propan-2-ylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-ethylphenyl)-N4-(4-propan-2-ylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-ethylphenyl)-N4-(4-isopropylphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-ethylphenyl)-N4-(4-propan-2-ylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-ethylphenyl)-4-N-(4-propan-2-ylphenyl)pyrimidine-4,5,6-triamine Traditional Name: (5-amino-6-cumidino-pyrimidin-4-yl)-(4-ethylphenyl)amine Formula: C21H25N5 MolecularWeight: 347.4567

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)N

InChI

InChI=1S/C21H25N5/c1-4-15-5-9-17(10-6-15)25-20-19(22)21(24-13-23-20)26-18-11-7-16(8-12-18)14(2)3/h5-14H,4,22H2,1-3H3,(H2,23,24,25,26)