4-[5-methyl-1-phenyl-3-(pyridin-2-ylmethylsulfanyl)pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-[5-methyl-1-phenyl-3-(pyridin-2-ylmethylsulfanyl)pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[5-methyl-1-phenyl-3-(2-pyridylmethylsulfanyl)pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[5-methyl-1-phenyl-3-(2-pyridinylmethylthio)-4-pyrazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[5-methyl-1-phenyl-3-(pyridin-2-ylmethylsulfanyl)pyrazol-4-yl]-N-phenylpyrimidin-2-amine Traditional Name: [4-[5-methyl-1-phenyl-3-(2-pyridylmethylthio)pyrazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C26H22N6S MolecularWeight: 450.55808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SCC3=CC=CC=N3)C4=NC(=NC=C4)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SCC3=CC=CC=N3)C4=NC(=NC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C26H22N6S/c1-19-24(23-15-17-28-26(30-23)29-20-10-4-2-5-11-20)25(33-18-21-12-8-9-16-27-21)31-32(19)22-13-6-3-7-14-22/h2-17H,18H2,1H3,(H,28,29,30)