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

Systemtic Name: 4-[5-methyl-3-(1-methylpiperidin-4-yl)sulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[5-methyl-3-[(1-methyl-4-piperidyl)sulfanyl]-1-phenyl-pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[5-methyl-3-[(1-methyl-4-piperidinyl)thio]-1-phenyl-4-pyrazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[5-methyl-3-(1-methylpiperidin-4-yl)sulfanyl-1-phenylpyrazol-4-yl]-N-phenylpyrimidin-2-amine Traditional Name: [4-[5-methyl-3-[(1-methyl-4-piperidyl)thio]-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C26H28N6S MolecularWeight: 456.60572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SC3CCN(CC3)C)C4=NC(=NC=C4)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SC3CCN(CC3)C)C4=NC(=NC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C26H28N6S/c1-19-24(23-13-16-27-26(29-23)28-20-9-5-3-6-10-20)25(33-22-14-17-31(2)18-15-22)30-32(19)21-11-7-4-8-12-21/h3-13,16,22H,14-15,17-18H2,1-2H3,(H,27,28,29)