N-(3-chloranyl-2-methyl-phenyl)-4-[6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-[6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-[6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[6-(3,5-dimethyl-1-pyrazolyl)-2-methyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-[6-(3,5-dimethylpyrazol-1-yl)-2-methylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-[6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C22H26ClN7O MolecularWeight: 439.94114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC(=NC(=N2)C)N3CCN(CC3)C(=O)NC4=C(C(=CC=C4)Cl)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC(=NC(=N2)C)N3CCN(CC3)C(=O)NC4=C(C(=CC=C4)Cl)C)C

InChI

InChI=1S/C22H26ClN7O/c1-14-12-15(2)30(27-14)21-13-20(24-17(4)25-21)28-8-10-29(11-9-28)22(31)26-19-7-5-6-18(23)16(19)3/h5-7,12-13H,8-11H2,1-4H3,(H,26,31)