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

Systemtic Name: N4-(3-chloranyl-2-methyl-phenyl)-N6-pyridin-4-yl-pyrimidine-4,5,6-triamine Openeye Name: N4-(3-chloro-2-methyl-phenyl)-N6-(4-pyridyl)pyrimidine-4,5,6-triamine CAS Name: N4-(3-chloro-2-methylphenyl)-N6-pyridin-4-ylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3-chloro-2-methylphenyl)-6-N-pyridin-4-ylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3-chloro-2-methyl-anilino)pyrimidin-4-yl]-(4-pyridyl)amine Formula: C16H15ClN6 MolecularWeight: 326.7835

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=C(C(=NC=N2)NC3=CC=NC=C3)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=C(C(=NC=N2)NC3=CC=NC=C3)N

InChI

InChI=1S/C16H15ClN6/c1-10-12(17)3-2-4-13(10)23-16-14(18)15(20-9-21-16)22-11-5-7-19-8-6-11/h2-9H,18H2,1H3,(H2,19,20,21,22,23)