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

Systemtic Name: 1-(4-bromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyrrolidine-2,5-dione Openeye Name: 1-(4-bromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-pyrrolidine-2,5-dione CAS Name: 1-(4-bromophenyl)-3-[(4,6-dimethyl-2-pyrimidinyl)thio]pyrrolidine-2,5-dione IUPAC Name: 1-(4-bromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione Traditional Name: 1-(4-bromophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)thio]pyrrolidine-2,5-quinone Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O2S/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