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

Systemtic Name: 6-(4-chlorophenyl)-2-[2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Openeye Name: 6-(4-chlorophenyl)-2-[2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]ethyl]pyridazin-3-one CAS Name: 6-(4-chlorophenyl)-2-[2-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]ethyl]-3-pyridazinone IUPAC Name: 6-(4-chlorophenyl)-2-[2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethyl]pyridazin-3-one Traditional Name: 6-(4-chlorophenyl)-2-[2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]ethyl]pyridazin-3-one Formula: C21H23ClN4O3S2 MolecularWeight: 479.01532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

InChI

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