2-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one Openeye Name: 2-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one CAS Name: 2-[2-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-6-(4-ethoxyphenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]ethyl]-6-p-phenetyl-pyridazin-3-one Formula: C26H32N4O6S MolecularWeight: 528.62048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCN3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCN3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H32N4O6S/c1-4-36-21-7-5-20(6-8-21)23-10-12-26(31)30(27-23)18-15-28-13-16-29(17-14-28)37(32,33)25-19-22(34-2)9-11-24(25)35-3/h5-12,19H,4,13-18H2,1-3H3