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

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-3-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-3-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-3-pyrazolyl]-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-yl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-3-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=NN(C=C3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

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

InChI

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