(3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazino]methanone Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-15-5-6-16(2)20(13-15)29(25,26)23-11-9-22(10-12-23)21(24)17-7-8-18(27-3)19(14-17)28-4/h5-8,13-14H,9-12H2,1-4H3