[3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [3-methyl-5-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]phenyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-(4-methylpiperazino)methanone Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

InChI

InChI=1S/C26H27N7O/c1-19-16-20(25(34)32-14-12-31(2)13-15-32)18-21(17-19)29-26-27-10-8-23(30-26)24-9-11-28-33(24)22-6-4-3-5-7-22/h3-11,16-18H,12-15H2,1-2H3,(H,27,29,30)