5-[5-bromanyl-6-piperazin-1-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]-3-methyl-1,2,4-thiadiazole

Systemtic Name: 5-[5-bromanyl-6-piperazin-1-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]-3-methyl-1,2,4-thiadiazole Openeye Name: 5-[5-bromo-6-piperazin-1-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]-3-methyl-1,2,4-thiadiazole CAS Name: 5-[5-bromo-6-(1-piperazinyl)-4-[3-(trifluoromethyl)phenyl]-3-pyridazinyl]-3-methyl-1,2,4-thiadiazole IUPAC Name: 5-[5-bromo-6-piperazin-1-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]-3-methyl-1,2,4-thiadiazole Traditional Name: 5-[5-bromo-6-piperazino-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]-3-methyl-1,2,4-thiadiazole Formula: C18H16BrF3N6S MolecularWeight: 485.32405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=N1)C2=NN=C(C(=C2C3=CC(=CC=C3)C(F)(F)F)Br)N4CCNCC4

Isomeric SMILES

CC1=NSC(=N1)C2=NN=C(C(=C2C3=CC(=CC=C3)C(F)(F)F)Br)N4CCNCC4

InChI

InChI=1S/C18H16BrF3N6S/c1-10-24-17(29-27-10)15-13(11-3-2-4-12(9-11)18(20,21)22)14(19)16(26-25-15)28-7-5-23-6-8-28/h2-4,9,23H,5-8H2,1H3