N4-(3,5-dimethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3,5-dimethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine Openeye Name: N4-(3,5-dimethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine CAS Name: N4-(3,5-dimethylphenyl)-N6-phenethylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-N-phenethylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]-phenethyl-amine Formula: C20H23N5 MolecularWeight: 333.43012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)N)C

InChI

InChI=1S/C20H23N5/c1-14-10-15(2)12-17(11-14)25-20-18(21)19(23-13-24-20)22-9-8-16-6-4-3-5-7-16/h3-7,10-13H,8-9,21H2,1-2H3,(H2,22,23,24,25)