(3S)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fluorophenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fluorophenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fluorophenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-(4-fluorophenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fluorophenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-[(4,6-dimethylpyrimidin-2-yl)thio]-1-(4-fluorophenyl)pyrrolidine-2,5-quinone Formula: C16H14FN3O2S MolecularWeight: 331.364663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)S[C@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C16H14FN3O2S/c1-9-7-10(2)19-16(18-9)23-13-8-14(21)20(15(13)22)12-5-3-11(17)4-6-12/h3-7,13H,8H2,1-2H3/t13-/m0/s1