2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(2,6-dimethyl-4-pyrimidinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(2,6-dimethylpyrimidin-4-yl)thio]-1-pyrrolidino-ethanone Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SCC(=O)N2CCCC2

Isomeric SMILES

CC1=CC(=NC(=N1)C)SCC(=O)N2CCCC2

InChI

InChI=1S/C12H17N3OS/c1-9-7-11(14-10(2)13-9)17-8-12(16)15-5-3-4-6-15/h7H,3-6,8H2,1-2H3