2-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methylphenyl)pyridazin-3-one

Systemtic Name: 2-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methylphenyl)pyridazin-3-one Openeye Name: 2-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]ethyl]-6-(p-tolyl)pyridazin-3-one CAS Name: 2-[2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]ethyl]-6-(4-methylphenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methylphenyl)pyridazin-3-one Traditional Name: 2-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]ethyl]-6-(p-tolyl)pyridazin-3-one Formula: C21H23ClN4O3S2 MolecularWeight: 479.01532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H23ClN4O3S2/c1-16-2-4-17(5-3-16)18-6-8-20(27)26(23-18)15-12-24-10-13-25(14-11-24)31(28,29)21-9-7-19(22)30-21/h2-9H,10-15H2,1H3