N4-(3-chloranyl-2-methyl-phenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3-chloranyl-2-methyl-phenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(3-chloro-2-methyl-phenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine CAS Name: N4-(3-chloro-2-methylphenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3-chloro-2-methylphenyl)-6-N-(4-ethylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3-chloro-2-methyl-anilino)pyrimidin-4-yl]-(4-ethylphenyl)amine Formula: C19H20ClN5 MolecularWeight: 353.8486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN5/c1-3-13-7-9-14(10-8-13)24-18-17(21)19(23-11-22-18)25-16-6-4-5-15(20)12(16)2/h4-11H,3,21H2,1-2H3,(H2,22,23,24,25)