4-(5-methyl-3-methylsulfanyl-1-pyridin-2-yl-pyrazol-4-yl)-N-(3-phenylmethoxyphenyl)pyrimidin-2-amine

Systemtic Name: 4-(5-methyl-3-methylsulfanyl-1-pyridin-2-yl-pyrazol-4-yl)-N-(3-phenylmethoxyphenyl)pyrimidin-2-amine Openeye Name: N-(3-benzyloxyphenyl)-4-[5-methyl-3-methylsulfanyl-1-(2-pyridyl)pyrazol-4-yl]pyrimidin-2-amine CAS Name: 4-[5-methyl-3-(methylthio)-1-(2-pyridinyl)-4-pyrazolyl]-N-(3-phenylmethoxyphenyl)-2-pyrimidinamine IUPAC Name: 4-(5-methyl-3-methylsulfanyl-1-pyridin-2-ylpyrazol-4-yl)-N-(3-phenylmethoxyphenyl)pyrimidin-2-amine Traditional Name: (3-benzoxyphenyl)-[4-[5-methyl-3-(methylthio)-1-(2-pyridyl)pyrazol-4-yl]pyrimidin-2-yl]amine Formula: C27H24N6OS MolecularWeight: 480.58406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=N2)SC)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=N2)SC)C3=NC(=NC=C3)NC4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H24N6OS/c1-19-25(26(35-2)32-33(19)24-13-6-7-15-28-24)23-14-16-29-27(31-23)30-21-11-8-12-22(17-21)34-18-20-9-4-3-5-10-20/h3-17H,18H2,1-2H3,(H,29,30,31)