[4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-iodanylphenyl)methanone

Systemtic Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-iodanylphenyl)methanone Openeye Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazin-1-yl]-(2-iodophenyl)methanone CAS Name: [4-(6-cyclohexyloxy-3-pyridazinyl)-1-piperazinyl]-(2-iodophenyl)methanone IUPAC Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-iodophenyl)methanone Traditional Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazino]-(2-iodophenyl)methanone Formula: C21H25IN4O2 MolecularWeight: 492.35327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4I

Isomeric SMILES

C1CCC(CC1)OC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4I

InChI

InChI=1S/C21H25IN4O2/c22-18-9-5-4-8-17(18)21(27)26-14-12-25(13-15-26)19-10-11-20(24-23-19)28-16-6-2-1-3-7-16/h4-5,8-11,16H,1-3,6-7,12-15H2