2-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylic acid Openeye Name: 2-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylic acid CAS Name: 2-methyl-5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-furancarboxylic acid IUPAC Name: 2-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylic acid Traditional Name: 2-methyl-5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-furoic acid Formula: C10H11N3O3S MolecularWeight: 253.27764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NN=CN2C)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NN=CN2C)C(=O)O

InChI

InChI=1S/C10H11N3O3S/c1-6-8(9(14)15)3-7(16-6)4-17-10-12-11-5-13(10)2/h3,5H,4H2,1-2H3,(H,14,15)