2-[2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-chlorophenyl)pyridazin-3-one

Systemtic Name: 2-[2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-chlorophenyl)pyridazin-3-one Openeye Name: 2-[2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-chlorophenyl)pyridazin-3-one CAS Name: 2-[2-[4-(4-butoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-6-(4-chlorophenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-chlorophenyl)pyridazin-3-one Traditional Name: 2-[2-[4-(4-butoxyphenyl)sulfonylpiperazino]ethyl]-6-(4-chlorophenyl)pyridazin-3-one Formula: C26H31ClN4O4S MolecularWeight: 531.06674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H31ClN4O4S/c1-2-3-20-35-23-8-10-24(11-9-23)36(33,34)30-17-14-29(15-18-30)16-19-31-26(32)13-12-25(28-31)21-4-6-22(27)7-5-21/h4-13H,2-3,14-20H2,1H3