2-[(1S,2S)-2-[2-(phenylsulfonyl)-2-pyridin-2-ylsulfanyl-ethyl]-2,3-dihydro-1H-inden-1-yl]ethanenitrile

Systemtic Name: 2-[(1S,2S)-2-[2-(phenylsulfonyl)-2-pyridin-2-ylsulfanyl-ethyl]-2,3-dihydro-1H-inden-1-yl]ethanenitrile Openeye Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)-2-(2-pyridylsulfanyl)ethyl]indan-1-yl]acetonitrile CAS Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)-2-(2-pyridinylthio)ethyl]-2,3-dihydro-1H-inden-1-yl]acetonitrile IUPAC Name: 2-[(1S,2S)-2-[2-(benzenesulfonyl)-2-pyridin-2-ylsulfanylethyl]-2,3-dihydro-1H-inden-1-yl]acetonitrile Traditional Name: 2-[(1S,2S)-2-[2-besyl-2-(2-pyridylthio)ethyl]indan-1-yl]acetonitrile Formula: C24H22N2O2S2 MolecularWeight: 434.57368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C21)CC#N)CC(SC3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1[C@H]([C@@H](C2=CC=CC=C21)CC#N)CC(SC3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S2/c25-14-13-22-19(16-18-8-4-5-11-21(18)22)17-24(29-23-12-6-7-15-26-23)30(27,28)20-9-2-1-3-10-20/h1-12,15,19,22,24H,13,16-17H2/t19-,22-,24?/m0/s1