S-[(4-methylsulfanylphenyl)methyl] pyrrolidine-1-carbothioate

Systemtic Name: S-[(4-methylsulfanylphenyl)methyl] pyrrolidine-1-carbothioate Openeye Name: S-[(4-methylsulfanylphenyl)methyl] pyrrolidine-1-carbothioate CAS Name: 1-pyrrolidinecarbothioic acid S-[[4-(methylthio)phenyl]methyl] ester IUPAC Name: S-[(4-methylsulfanylphenyl)methyl] pyrrolidine-1-carbothioate Traditional Name: pyrrolidine-1-carbothioic acid S-[4-(methylthio)benzyl] ester Formula: C13H17NOS2 MolecularWeight: 267.41018

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC(=O)N2CCCC2

Isomeric SMILES

CSC1=CC=C(C=C1)CSC(=O)N2CCCC2

InChI

InChI=1S/C13H17NOS2/c1-16-12-6-4-11(5-7-12)10-17-13(15)14-8-2-3-9-14/h4-7H,2-3,8-10H2,1H3