N4-(4-chloranyl-3-methoxy-phenyl)-5-methyl-N2-[4-(pyrazol-1-ylmethyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-(4-chloranyl-3-methoxy-phenyl)-5-methyl-N2-[4-(pyrazol-1-ylmethyl)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(4-chloro-3-methoxy-phenyl)-5-methyl-N2-[4-(pyrazol-1-ylmethyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-(4-chloro-3-methoxyphenyl)-5-methyl-N2-[4-(1-pyrazolylmethyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(4-chloro-3-methoxyphenyl)-5-methyl-2-N-[4-(pyrazol-1-ylmethyl)phenyl]pyrimidine-2,4-diamine Traditional Name: [4-(4-chloro-3-methoxy-anilino)-5-methyl-pyrimidin-2-yl]-[4-(pyrazol-1-ylmethyl)phenyl]amine Formula: C22H21ClN6O MolecularWeight: 420.89474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC(=C(C=C2)Cl)OC)NC3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC(=C(C=C2)Cl)OC)NC3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C22H21ClN6O/c1-15-13-24-22(28-21(15)26-18-8-9-19(23)20(12-18)30-2)27-17-6-4-16(5-7-17)14-29-11-3-10-25-29/h3-13H,14H2,1-2H3,(H2,24,26,27,28)