1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]pyridazine-3-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]pyridazine-3-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxamide CAS Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-3-pyridazinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-1-(2-fluorophenyl)-4-keto-6-methyl-pyridazine-3-carboxamide Formula: C26H30FN5O2 MolecularWeight: 463.547103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H30FN5O2/c1-20-18-24(33)25(29-32(20)23-11-6-5-10-22(23)27)26(34)28-12-7-13-30-14-16-31(17-15-30)19-21-8-3-2-4-9-21/h2-6,8-11,18H,7,12-17,19H2,1H3,(H,28,34)