2-ethoxyethyl 6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate

Systemtic Name: 2-ethoxyethyl 6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate Openeye Name: 2-ethoxyethyl 6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate CAS Name: 6-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-pyridinecarboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate Traditional Name: 6-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]nicotinic acid 2-ethoxyethyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=CN=C(C=C1)SC2=NNC(=N2)C

Isomeric SMILES

CCOCCOC(=O)C1=CN=C(C=C1)SC2=NNC(=N2)C

InChI

InChI=1S/C13H16N4O3S/c1-3-19-6-7-20-12(18)10-4-5-11(14-8-10)21-13-15-9(2)16-17-13/h4-5,8H,3,6-7H2,1-2H3,(H,15,16,17)