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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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