4-[1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]-N-cyclohexyl-pyrimidin-2-amine

Systemtic Name: 4-[1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]-N-cyclohexyl-pyrimidin-2-amine Openeye Name: 4-[1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]-N-cyclohexyl-pyrimidin-2-amine CAS Name: 4-[1-(3-chlorophenyl)-3-methyl-4-pyrazolyl]-N-cyclohexyl-2-pyrimidinamine IUPAC Name: 4-[1-(3-chlorophenyl)-3-methylpyrazol-4-yl]-N-cyclohexylpyrimidin-2-amine Traditional Name: [4-[1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]pyrimidin-2-yl]-cyclohexyl-amine Formula: C20H22ClN5 MolecularWeight: 367.87518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC(=NC=C2)NC3CCCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C=C1C2=NC(=NC=C2)NC3CCCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H22ClN5/c1-14-18(13-26(25-14)17-9-5-6-15(21)12-17)19-10-11-22-20(24-19)23-16-7-3-2-4-8-16/h5-6,9-13,16H,2-4,7-8H2,1H3,(H,22,23,24)