1-[3-ethyl-3-[(phenylmethylsulfanyl)methyl]-1H-isoindol-2-yl]ethanone

Systemtic Name: 1-[3-ethyl-3-[(phenylmethylsulfanyl)methyl]-1H-isoindol-2-yl]ethanone Openeye Name: 1-[1-(benzylsulfanylmethyl)-1-ethyl-isoindolin-2-yl]ethanone CAS Name: 1-[3-ethyl-3-[(phenylmethylthio)methyl]-1H-isoindol-2-yl]ethanone IUPAC Name: 1-[3-(benzylsulfanylmethyl)-3-ethyl-1H-isoindol-2-yl]ethanone Traditional Name: 1-[1-[(benzylthio)methyl]-1-ethyl-isoindolin-2-yl]ethanone Formula: C20H23NOS MolecularWeight: 325.46772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2CN1C(=O)C)CSCC3=CC=CC=C3

Isomeric SMILES

CCC1(C2=CC=CC=C2CN1C(=O)C)CSCC3=CC=CC=C3

InChI

InChI=1S/C20H23NOS/c1-3-20(15-23-14-17-9-5-4-6-10-17)19-12-8-7-11-18(19)13-21(20)16(2)22/h4-12H,3,13-15H2,1-2H3