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

Systemtic Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-yl-methanone Openeye Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-yl-methanone CAS Name: [3-methyl-5-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]phenyl]-(1-piperazinyl)methanone IUPAC Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone Traditional Name: [3-methyl-5-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]phenyl]-piperazino-methanone Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCNCC2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCNCC2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5

InChI

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