(Z)-2-methylsulfanyl-3-pyridin-2-yl-prop-2-enoic acid

Systemtic Name: (Z)-2-methylsulfanyl-3-pyridin-2-yl-prop-2-enoic acid Openeye Name: (Z)-2-methylsulfanyl-3-(2-pyridyl)prop-2-enoic acid CAS Name: (Z)-2-(methylthio)-3-(2-pyridinyl)-2-propenoic acid IUPAC Name: (Z)-2-methylsulfanyl-3-pyridin-2-ylprop-2-enoic acid Traditional Name: (Z)-2-(methylthio)-3-(2-pyridyl)acrylic acid Formula: C9H9NO2S MolecularWeight: 195.23826

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC1=CC=CC=N1)C(=O)O

Isomeric SMILES

CS/C(=C\C1=CC=CC=N1)/C(=O)O

InChI

InChI=1S/C9H9NO2S/c1-13-8(9(11)12)6-7-4-2-3-5-10-7/h2-6H,1H3,(H,11,12)/b8-6-