1-[5-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfanyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-[(2S)-3-(methylamino)-2-oxidanyl-propyl]sulfanyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfanylindolin-1-yl]ethanone CAS Name: 1-[5-[[(2S)-2-hydroxy-3-(methylamino)propyl]thio]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-[(2S)-2-hydroxy-3-(methylamino)propyl]sulfanyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-[[(2S)-2-hydroxy-3-(methylamino)propyl]thio]indolin-1-yl]ethanone Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)SCC(CNC)O

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)SC[C@H](CNC)O

InChI

InChI=1S/C14H20N2O2S/c1-10(17)16-6-5-11-7-13(3-4-14(11)16)19-9-12(18)8-15-2/h3-4,7,12,15,18H,5-6,8-9H2,1-2H3/t12-/m0/s1