(2R)-1-(2,3-dihydroindol-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-indolin-1-yl-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]propan-1-one CAS Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-1-propanone IUPAC Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-indolin-1-yl-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propan-1-one Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H23N3O3S2/c1-15(20(24)23-13-10-16-6-2-3-7-18(16)23)27-19-9-8-17(14-21-19)28(25,26)22-11-4-5-12-22/h2-3,6-9,14-15H,4-5,10-13H2,1H3/t15-/m1/s1