1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-3-naphthalen-2-yloxy-propan-2-ol

Systemtic Name: 1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-3-naphthalen-2-yloxy-propan-2-ol Openeye Name: 1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-3-(2-naphthyloxy)propan-2-ol CAS Name: 1-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-3-(2-naphthalenyloxy)-2-propanol IUPAC Name: 1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-3-naphthalen-2-yloxypropan-2-ol Traditional Name: 1-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-3-(2-naphthoxy)propan-2-ol Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(COC3=CC4=CC=CC=C4C=C3)O)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(COC3=CC4=CC=CC=C4C=C3)O)C

InChI

InChI=1S/C22H22N4O2S/c1-15-11-16(2)26(25-15)21-9-10-22(24-23-21)29-14-19(27)13-28-20-8-7-17-5-3-4-6-18(17)12-20/h3-12,19,27H,13-14H2,1-2H3