(4-methylpiperazin-1-yl)-[4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methanone CAS Name: (4-methyl-1-piperazinyl)-[4-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]phenyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methanone Traditional Name: (4-methylpiperazino)-[4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]methanone Formula: C25H25N7O MolecularWeight: 439.5123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

InChI

InChI=1S/C25H25N7O/c1-30-15-17-31(18-16-30)24(33)19-7-9-20(10-8-19)28-25-26-13-11-22(29-25)23-12-14-27-32(23)21-5-3-2-4-6-21/h2-14H,15-18H2,1H3,(H,26,28,29)