6-[[5-(2-methoxyethyl)-4-methyl-thiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanyl-pyridine-2-carboxylic acid

Systemtic Name: 6-[[5-(2-methoxyethyl)-4-methyl-thiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanyl-pyridine-2-carboxylic acid Openeye Name: 6-[[5-(2-methoxyethyl)-4-methyl-2-thienyl]sulfonylcarbamoylamino]-4-methylsulfanyl-pyridine-2-carboxylic acid CAS Name: 6-[[[[5-(2-methoxyethyl)-4-methyl-2-thiophenyl]sulfonylamino]-oxomethyl]amino]-4-(methylthio)-2-pyridinecarboxylic acid IUPAC Name: 6-[[5-(2-methoxyethyl)-4-methylthiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanylpyridine-2-carboxylic acid Traditional Name: 6-[[5-(2-methoxyethyl)-4-methyl-2-thienyl]sulfonylcarbamoylamino]-4-(methylthio)picolinic acid Formula: C16H19N3O6S3 MolecularWeight: 445.53356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)NC(=O)NC2=CC(=CC(=N2)C(=O)O)SC)CCOC

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)NC(=O)NC2=CC(=CC(=N2)C(=O)O)SC)CCOC

InChI

InChI=1S/C16H19N3O6S3/c1-9-6-14(27-12(9)4-5-25-2)28(23,24)19-16(22)18-13-8-10(26-3)7-11(17-13)15(20)21/h6-8H,4-5H2,1-3H3,(H,20,21)(H2,17,18,19,22)