N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C21H17F6N5OS MolecularWeight: 501.447999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H17F6N5OS/c22-20(23,24)13-10-14(21(25,26)27)12-15(11-13)28-19(33)32-7-5-31(6-8-32)18-4-3-16(29-30-18)17-2-1-9-34-17/h1-4,9-12H,5-8H2,(H,28,33)