1-[(5S)-5-(4-chlorophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[(5S)-5-(4-chlorophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[(5S)-5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]ethanone CAS Name: 1-[(5S)-5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[(5S)-5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[(5S)-5-(4-chlorophenyl)-5-hydroxy-3-methyl-2-pyrazolin-1-yl]ethanone Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CC1=NN([C@](C1)(C2=CC=C(C=C2)Cl)O)C(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C19H19ClN2O2S/c1-14-11-19(24,16-7-9-17(20)10-8-16)22(21-14)18(23)13-25-12-15-5-3-2-4-6-15/h2-10,24H,11-13H2,1H3/t19-/m0/s1