1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione

Systemtic Name: 1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione Openeye Name: 1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione CAS Name: 1-[2-(4-fluorophenyl)-1-pyrrolidinyl]-4-[4-(methylthio)phenyl]butane-1,4-dione IUPAC Name: 1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione Traditional Name: 1-[2-(4-fluorophenyl)pyrrolidino]-4-[4-(methylthio)phenyl]butane-1,4-dione Formula: C21H22FNO2S MolecularWeight: 371.468283

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CCC(=O)N2CCCC2C3=CC=C(C=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CCC(=O)N2CCCC2C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FNO2S/c1-26-18-10-6-16(7-11-18)20(24)12-13-21(25)23-14-2-3-19(23)15-4-8-17(22)9-5-15/h4-11,19H,2-3,12-14H2,1H3