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

Systemtic Name: 6-(4-ethoxyphenyl)-2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(4-ethoxyphenyl)-2-[2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-ethoxyphenyl)-2-[2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-ethoxyphenyl)-2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 6-p-phenetyl-2-[2-[4-(2-thienylsulfonyl)piperazino]ethyl]pyridazin-3-one Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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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=CS4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCN3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H26N4O4S2/c1-2-30-19-7-5-18(6-8-19)20-9-10-21(27)26(23-20)16-13-24-11-14-25(15-12-24)32(28,29)22-4-3-17-31-22/h3-10,17H,2,11-16H2,1H3