1-[4-(6-naphthalen-2-ylpyridazin-3-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(6-naphthalen-2-ylpyridazin-3-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one Openeye Name: 1-[4-[6-(2-naphthyl)pyridazin-3-yl]piperazin-1-yl]-3-phenylsulfanyl-propan-1-one CAS Name: 1-[4-[6-(2-naphthalenyl)-3-pyridazinyl]-1-piperazinyl]-3-(phenylthio)-1-propanone IUPAC Name: 1-[4-(6-naphthalen-2-ylpyridazin-3-yl)piperazin-1-yl]-3-phenylsulfanylpropan-1-one Traditional Name: 1-[4-[6-(2-naphthyl)pyridazin-3-yl]piperazino]-3-(phenylthio)propan-1-one Formula: C27H26N4OS MolecularWeight: 454.58654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)CCSC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)CCSC5=CC=CC=C5

InChI

InChI=1S/C27H26N4OS/c32-27(14-19-33-24-8-2-1-3-9-24)31-17-15-30(16-18-31)26-13-12-25(28-29-26)23-11-10-21-6-4-5-7-22(21)20-23/h1-13,20H,14-19H2