N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C18H15ClFN7O MolecularWeight: 399.809403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CN2C=CC(=N2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1=CN(N=C1)CN2C=CC(=N2)C(=O)NC3=CN(N=C3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C18H15ClFN7O/c19-16-8-14(20)3-2-13(16)10-27-11-15(9-22-27)23-18(28)17-4-7-26(24-17)12-25-6-1-5-21-25/h1-9,11H,10,12H2,(H,23,28)