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

Systemtic Name: 5-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[(1-cyclopentyl-5-tetrazolyl)thio]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[(1-cyclopentyltetrazol-5-yl)thio]methyl]-2-methyl-3-furoic acid Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NN=NN2C3CCCC3)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NN=NN2C3CCCC3)C(=O)O

InChI

InChI=1S/C13H16N4O3S/c1-8-11(12(18)19)6-10(20-8)7-21-13-14-15-16-17(13)9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H,18,19)