1-[4-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[(2,5-dimethylphenyl)methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(2,5-dimethylbenzyl)piperazino]sulfonylphenyl]ethanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H26N2O3S/c1-16-4-5-17(2)20(14-16)15-22-10-12-23(13-11-22)27(25,26)21-8-6-19(7-9-21)18(3)24/h4-9,14H,10-13,15H2,1-3H3