N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(6-phenyl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Formula: C22H19ClF3N5O MolecularWeight: 461.86737

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C22H19ClF3N5O/c23-17-7-6-16(22(24,25)26)14-19(17)27-21(32)31-12-10-30(11-13-31)20-9-8-18(28-29-20)15-4-2-1-3-5-15/h1-9,14H,10-13H2,(H,27,32)