(E)-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enoic acid Openeye Name: (E)-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enoic acid CAS Name: (E)-3-[2-(methylthio)-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-(2-methylsulfanylpyrimidin-5-yl)prop-2-enoic acid Traditional Name: (E)-3-[2-(methylthio)pyrimidin-5-yl]acrylic acid Formula: C8H8N2O2S MolecularWeight: 196.22632

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C=CC(=O)O

Isomeric SMILES

CSC1=NC=C(C=N1)/C=C/C(=O)O

InChI

InChI=1S/C8H8N2O2S/c1-13-8-9-4-6(5-10-8)2-3-7(11)12/h2-5H,1H3,(H,11,12)/b3-2+