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

Systemtic Name: N4-(5-chloranyl-2,4-dimethoxy-phenyl)-N6-pyridin-4-yl-pyrimidine-4,5,6-triamine Openeye Name: N4-(5-chloro-2,4-dimethoxy-phenyl)-N6-(4-pyridyl)pyrimidine-4,5,6-triamine CAS Name: N4-(5-chloro-2,4-dimethoxyphenyl)-N6-pyridin-4-ylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(5-chloro-2,4-dimethoxyphenyl)-6-N-pyridin-4-ylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(5-chloro-2,4-dimethoxy-anilino)pyrimidin-4-yl]-(4-pyridyl)amine Formula: C17H17ClN6O2 MolecularWeight: 372.80888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC=NC(=C2N)NC3=CC=NC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC=NC(=C2N)NC3=CC=NC=C3)Cl)OC

InChI

InChI=1S/C17H17ClN6O2/c1-25-13-8-14(26-2)12(7-11(13)18)24-17-15(19)16(21-9-22-17)23-10-3-5-20-6-4-10/h3-9H,19H2,1-2H3,(H2,20,21,22,23,24)