2-methyl-5-(pyrimidin-2-ylsulfanylmethyl)furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-(pyrimidin-2-ylsulfanylmethyl)furan-3-carboxylic acid Openeye Name: 2-methyl-5-(pyrimidin-2-ylsulfanylmethyl)furan-3-carboxylic acid CAS Name: 2-methyl-5-[(2-pyrimidinylthio)methyl]-3-furancarboxylic acid IUPAC Name: 2-methyl-5-(pyrimidin-2-ylsulfanylmethyl)furan-3-carboxylic acid Traditional Name: 2-methyl-5-[(2-pyrimidylthio)methyl]-3-furoic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC=CC=N2)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC=CC=N2)C(=O)O

InChI

InChI=1S/C11H10N2O3S/c1-7-9(10(14)15)5-8(16-7)6-17-11-12-3-2-4-13-11/h2-5H,6H2,1H3,(H,14,15)