N4-(5-tert-butyl-1H-pyrazol-3-yl)-N2-[4-(pyridin-3-ylmethyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-(5-tert-butyl-1H-pyrazol-3-yl)-N2-[4-(pyridin-3-ylmethyl)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(5-tert-butyl-1H-pyrazol-3-yl)-N2-[4-(3-pyridylmethyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-(5-tert-butyl-1H-pyrazol-3-yl)-N2-[4-(3-pyridinylmethyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-N-[4-(pyridin-3-ylmethyl)phenyl]pyrimidine-2,4-diamine Traditional Name: (5-tert-butyl-1H-pyrazol-3-yl)-[2-[4-(3-pyridylmethyl)anilino]pyrimidin-4-yl]amine Formula: C23H25N7 MolecularWeight: 399.4915

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)NC2=NC(=NC=C2)NC3=CC=C(C=C3)CC4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)NC2=NC(=NC=C2)NC3=CC=C(C=C3)CC4=CN=CC=C4

InChI

InChI=1S/C23H25N7/c1-23(2,3)19-14-21(30-29-19)27-20-10-12-25-22(28-20)26-18-8-6-16(7-9-18)13-17-5-4-11-24-15-17/h4-12,14-15H,13H2,1-3H3,(H3,25,26,27,28,29,30)