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

Systemtic Name: 2-[2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one Openeye Name: 2-[2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one CAS Name: 2-[2-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]ethyl]-6-(4-ethoxyphenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-ethoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-[4-(4-acetylphenyl)sulfonylpiperazino]ethyl]-6-p-phenetyl-pyridazin-3-one Formula: C26H30N4O5S MolecularWeight: 510.6052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N4O5S/c1-3-35-23-8-4-22(5-9-23)25-12-13-26(32)30(27-25)19-16-28-14-17-29(18-15-28)36(33,34)24-10-6-21(7-11-24)20(2)31/h4-13H,3,14-19H2,1-2H3