1-[3-[4-(3,5-dimethylphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(3,5-dimethylphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[(3,5-dimethylphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(3,5-dimethylbenzoyl)piperazino]sulfonylphenyl]ethanone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4S/c1-15-11-16(2)13-19(12-15)21(25)22-7-9-23(10-8-22)28(26,27)20-6-4-5-18(14-20)17(3)24/h4-6,11-14H,7-10H2,1-3H3