3-(4-methoxyphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-2-carboxylic acid

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-2-carboxylic acid Openeye Name: 3-(4-methoxyphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-2-carboxylic acid CAS Name: 3-[(4-methoxyphenyl)thio]-6-(1H-1,2,4-triazol-5-ylthio)-2-pyridinecarboxylic acid IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine-2-carboxylic acid Traditional Name: 3-[(4-methoxyphenyl)thio]-6-(1H-1,2,4-triazol-5-ylthio)picolinic acid Formula: C15H12N4O3S2 MolecularWeight: 360.41078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(N=C(C=C2)SC3=NC=NN3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(N=C(C=C2)SC3=NC=NN3)C(=O)O

InChI

InChI=1S/C15H12N4O3S2/c1-22-9-2-4-10(5-3-9)23-11-6-7-12(18-13(11)14(20)21)24-15-16-8-17-19-15/h2-8H,1H3,(H,20,21)(H,16,17,19)