1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(p-tolylmethylsulfanyl)ethanone CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-[(4-methylphenyl)methylthio]ethanone IUPAC Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-[(4-methylbenzyl)thio]ethanone Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25NO3S/c1-16-4-6-17(7-5-16)14-27-15-22(24)23-10-2-3-19(23)18-8-9-20-21(13-18)26-12-11-25-20/h4-9,13,19H,2-3,10-12,14-15H2,1H3