2-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-1H-pyridazine-3,6-dione CAS Name: 2-[2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione Traditional Name: 2-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-keto-ethyl]-1H-pyridazine-3,6-quinone Formula: C18H22N4O7S MolecularWeight: 438.45488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C=CC(=O)N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C=CC(=O)N3)OC

InChI

InChI=1S/C18H22N4O7S/c1-28-14-4-3-13(11-15(14)29-2)30(26,27)21-9-7-20(8-10-21)18(25)12-22-17(24)6-5-16(23)19-22/h3-6,11H,7-10,12H2,1-2H3,(H,19,23)