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

Systemtic Name: (2,5-dimethylphenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2,5-dimethylphenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2,5-dimethylphenyl)-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2,5-dimethylphenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2,5-dimethylphenyl)-[4-(2,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-15-6-8-20(18(4)13-15)27(25,26)23-11-9-22(10-12-23)21(24)19-14-16(2)5-7-17(19)3/h5-8,13-14H,9-12H2,1-4H3