[4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [4-(4-chloro-3,5-dimethyl-1-pyrazolyl)phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [4-(4-chloro-3,5-dimethylpyrazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)phenyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H21ClN6O MolecularWeight: 396.87334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4)C)Cl

InChI

InChI=1S/C20H21ClN6O/c1-14-18(21)15(2)27(24-14)17-6-4-16(5-7-17)19(28)25-10-12-26(13-11-25)20-22-8-3-9-23-20/h3-9H,10-13H2,1-2H3