2-[2-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[2-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[2-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 2-[2-[4-(2-methoxy-4,5-dimethylphenyl)sulfonyl-1-piperazinyl]ethyl]-6-(4-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[2-[4-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperazin-1-yl]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[2-[4-(2-methoxy-4,5-dimethyl-phenyl)sulfonylpiperazino]ethyl]-6-(4-methoxyphenyl)pyridazin-3-one Formula: C26H32N4O5S MolecularWeight: 512.62108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)CCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)OC)OC

InChI

InChI=1S/C26H32N4O5S/c1-19-17-24(35-4)25(18-20(19)2)36(32,33)29-14-11-28(12-15-29)13-16-30-26(31)10-9-23(27-30)21-5-7-22(34-3)8-6-21/h5-10,17-18H,11-16H2,1-4H3