4-(5-methyl-1-phenyl-3-phenylsulfanyl-pyrazol-4-yl)-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-(5-methyl-1-phenyl-3-phenylsulfanyl-pyrazol-4-yl)-N-phenyl-pyrimidin-2-amine Openeye Name: 4-(5-methyl-1-phenyl-3-phenylsulfanyl-pyrazol-4-yl)-N-phenyl-pyrimidin-2-amine CAS Name: 4-[5-methyl-1-phenyl-3-(phenylthio)-4-pyrazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-(5-methyl-1-phenyl-3-phenylsulfanylpyrazol-4-yl)-N-phenylpyrimidin-2-amine Traditional Name: [4-[5-methyl-1-phenyl-3-(phenylthio)pyrazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C26H21N5S MolecularWeight: 435.54344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SC3=CC=CC=C3)C4=NC(=NC=C4)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SC3=CC=CC=C3)C4=NC(=NC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C26H21N5S/c1-19-24(23-17-18-27-26(29-23)28-20-11-5-2-6-12-20)25(32-22-15-9-4-10-16-22)30-31(19)21-13-7-3-8-14-21/h2-18H,1H3,(H,27,28,29)