2-[(4-methylphenyl)methylsulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(p-tolylmethylsulfanyl)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(4-methylphenyl)methylthio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(4-methylbenzyl)thio]-1-pyrrolidino-ethanone Formula: C14H19NOS MolecularWeight: 249.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)N2CCCC2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)N2CCCC2

InChI

InChI=1S/C14H19NOS/c1-12-4-6-13(7-5-12)10-17-11-14(16)15-8-2-3-9-15/h4-7H,2-3,8-11H2,1H3