1-(2,3-dihydro-1H-inden-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-indan-5-yl-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-indan-5-yl-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]ethanone Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C20H22N2O3S2/c23-19(17-7-6-15-4-3-5-16(15)12-17)14-26-20-9-8-18(13-21-20)27(24,25)22-10-1-2-11-22/h6-9,12-13H,1-5,10-11,14H2