[4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[3-(methylsulfonylmethyl)phenyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfonylmethyl)phenyl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[3-(mesylmethyl)phenyl]methanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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