3-(2-azanylethylsulfanyl)-1-(4-fluorophenyl)pyrrolidine-2,5-dione hydrochloride

Systemtic Name: 3-(2-azanylethylsulfanyl)-1-(4-fluorophenyl)pyrrolidine-2,5-dione hydrochloride Openeye Name: 3-(2-aminoethylsulfanyl)-1-(4-fluorophenyl)pyrrolidine-2,5-dione hydrochloride CAS Name: 3-(2-aminoethylthio)-1-(4-fluorophenyl)pyrrolidine-2,5-dione hydrochloride IUPAC Name: 3-(2-aminoethylsulfanyl)-1-(4-fluorophenyl)pyrrolidine-2,5-dione hydrochloride Traditional Name: 3-(2-aminoethylthio)-1-(4-fluorophenyl)pyrrolidine-2,5-quinone hydrochloride Formula: C12H14ClFN2O2S MolecularWeight: 304.768163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)F)SCCN.Cl

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)F)SCCN.Cl

InChI

InChI=1S/C12H13FN2O2S.ClH/c13-8-1-3-9(4-2-8)15-11(16)7-10(12(15)17)18-6-5-14;/h1-4,10H,5-7,14H2;1H