1-[1-[2-(4-chlorophenyl)sulfanylethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperidine

Systemtic Name: 1-[1-[2-(4-chlorophenyl)sulfanylethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperidine Openeye Name: 1-[1-[2-(4-chlorophenyl)sulfanylethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperidine CAS Name: 1-[[1-[2-[(4-chlorophenyl)thio]ethyl]-3,5-dimethyl-4-pyrazolyl]sulfonyl]piperidine IUPAC Name: 1-[1-[2-(4-chlorophenyl)sulfanylethyl]-3,5-dimethylpyrazol-4-yl]sulfonylpiperidine Traditional Name: 1-[1-[2-[(4-chlorophenyl)thio]ethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylpiperidine Formula: C18H24ClN3O2S2 MolecularWeight: 413.98506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCSC2=CC=C(C=C2)Cl)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1CCSC2=CC=C(C=C2)Cl)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H24ClN3O2S2/c1-14-18(26(23,24)21-10-4-3-5-11-21)15(2)22(20-14)12-13-25-17-8-6-16(19)7-9-17/h6-9H,3-5,10-13H2,1-2H3