N6-[(4-chlorophenyl)methyl]-N4-(3,5-dimethylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-(3,5-dimethylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(3,5-dimethylphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(3,5-dimethylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-(3,5-dimethylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-chlorobenzyl)amino]pyrimidin-4-yl]-(3,5-dimethylphenyl)amine Formula: C19H20ClN5 MolecularWeight: 353.8486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)N)C

InChI

InChI=1S/C19H20ClN5/c1-12-7-13(2)9-16(8-12)25-19-17(21)18(23-11-24-19)22-10-14-3-5-15(20)6-4-14/h3-9,11H,10,21H2,1-2H3,(H2,22,23,24,25)