4-chloranyl-3,5-bis(1,3-dimethylpyrazol-4-yl)-1-[(4-fluorophenyl)methyl]pyrazole

Systemtic Name: 4-chloranyl-3,5-bis(1,3-dimethylpyrazol-4-yl)-1-[(4-fluorophenyl)methyl]pyrazole Openeye Name: 4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)-1-[(4-fluorophenyl)methyl]pyrazole CAS Name: 4-chloro-3,5-bis(1,3-dimethyl-4-pyrazolyl)-1-[(4-fluorophenyl)methyl]pyrazole IUPAC Name: 4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)-1-[(4-fluorophenyl)methyl]pyrazole Traditional Name: 4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)-1-(4-fluorobenzyl)pyrazole Formula: C20H20ClFN6 MolecularWeight: 398.864403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=C(C(=NN2CC3=CC=C(C=C3)F)C4=CN(N=C4C)C)Cl)C

Isomeric SMILES

CC1=NN(C=C1C2=C(C(=NN2CC3=CC=C(C=C3)F)C4=CN(N=C4C)C)Cl)C

InChI

InChI=1S/C20H20ClFN6/c1-12-16(10-26(3)23-12)19-18(21)20(17-11-27(4)24-13(17)2)28(25-19)9-14-5-7-15(22)8-6-14/h5-8,10-11H,9H2,1-4H3