1-(5-chloranylthiophen-2-yl)-4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(5-chloro-2-thienyl)-4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]butane-1,4-dione CAS Name: 1-(5-chloro-2-thiophenyl)-4-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(5-chlorothiophen-2-yl)-4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]butane-1,4-dione Traditional Name: 1-(5-chloro-2-thienyl)-4-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]butane-1,4-dione Formula: C20H23ClN2O6S2 MolecularWeight: 486.98942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H23ClN2O6S2/c1-28-14-3-5-16(29-2)18(13-14)31(26,27)23-11-9-22(10-12-23)20(25)8-4-15(24)17-6-7-19(21)30-17/h3,5-7,13H,4,8-12H2,1-2H3