(2S)-1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[4-(5-methyl-2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[4-(5-methyl-2-thiophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[4-(5-methyl-2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Formula: C15H13F3N3O2S- MolecularWeight: 356.34283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CC(=NC(=N2)N3CCCC3C(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC=C(S1)C2=CC(=NC(=N2)N3CCC[C@H]3C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H14F3N3O2S/c1-8-4-5-11(24-8)9-7-12(15(16,17)18)20-14(19-9)21-6-2-3-10(21)13(22)23/h4-5,7,10H,2-3,6H2,1H3,(H,22,23)/p-1/t10-/m0/s1