N2-[4-(1H-imidazol-5-yl)phenyl]-N4-(5-methoxy-2-methyl-phenyl)pyrimidine-2,4-diamine hydrochloride

Systemtic Name: N2-[4-(1H-imidazol-5-yl)phenyl]-N4-(5-methoxy-2-methyl-phenyl)pyrimidine-2,4-diamine hydrochloride Openeye Name: N2-[4-(1H-imidazol-5-yl)phenyl]-N4-(5-methoxy-2-methyl-phenyl)pyrimidine-2,4-diamine hydrochloride CAS Name: N2-[4-(1H-imidazol-5-yl)phenyl]-N4-(5-methoxy-2-methylphenyl)pyrimidine-2,4-diamine hydrochloride IUPAC Name: 2-N-[4-(1H-imidazol-5-yl)phenyl]-4-N-(5-methoxy-2-methylphenyl)pyrimidine-2,4-diamine hydrochloride Traditional Name: [2-[4-(1H-imidazol-5-yl)anilino]pyrimidin-4-yl]-(5-methoxy-2-methyl-phenyl)amine hydrochloride Formula: C21H21ClN6O MolecularWeight: 408.88404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C4=CN=CN4.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)OC)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C4=CN=CN4.Cl

InChI

InChI=1S/C21H20N6O.ClH/c1-14-3-8-17(28-2)11-18(14)26-20-9-10-23-21(27-20)25-16-6-4-15(5-7-16)19-12-22-13-24-19;/h3-13H,1-2H3,(H,22,24)(H2,23,25,26,27);1H