1-[4-chloranyl-3-(2-methylphenyl)-5-methylsulfonyl-phenyl]-4-ethyl-piperazine

Systemtic Name: 1-[4-chloranyl-3-(2-methylphenyl)-5-methylsulfonyl-phenyl]-4-ethyl-piperazine Openeye Name: 1-[4-chloro-3-methylsulfonyl-5-(o-tolyl)phenyl]-4-ethyl-piperazine CAS Name: 1-[4-chloro-3-(2-methylphenyl)-5-methylsulfonylphenyl]-4-ethylpiperazine IUPAC Name: 1-[4-chloro-3-(2-methylphenyl)-5-methylsulfonylphenyl]-4-ethylpiperazine Traditional Name: 1-[4-chloro-3-mesyl-5-(o-tolyl)phenyl]-4-ethyl-piperazine Formula: C20H25ClN2O2S MolecularWeight: 392.9427

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)S(=O)(=O)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O2S/c1-4-22-9-11-23(12-10-22)16-13-18(17-8-6-5-7-15(17)2)20(21)19(14-16)26(3,24)25/h5-8,13-14H,4,9-12H2,1-3H3