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

Systemtic Name: 6-(4-ethoxyphenyl)-2-[2-(4-ethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(4-ethoxyphenyl)-2-[2-(4-ethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one CAS Name: 6-(4-ethoxyphenyl)-2-[2-(4-ethylsulfonyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-ethoxyphenyl)-2-[2-(4-ethylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 2-[2-(4-esylpiperazino)ethyl]-6-p-phenetyl-pyridazin-3-one Formula: C20H28N4O4S MolecularWeight: 420.52572

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O4S/c1-3-28-18-7-5-17(6-8-18)19-9-10-20(25)24(21-19)16-13-22-11-14-23(15-12-22)29(26,27)4-2/h5-10H,3-4,11-16H2,1-2H3