ethyl 6-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate CAS Name: 6-[[4-ethyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate Traditional Name: 6-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]nicotinic acid ethyl ester Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=NC=C(C=C2)C(=O)OCC)C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1SC2=NC=C(C=C2)C(=O)OCC)C3=CC=CO3

InChI

InChI=1S/C16H16N4O3S/c1-3-20-14(12-6-5-9-23-12)18-19-16(20)24-13-8-7-11(10-17-13)15(21)22-4-2/h5-10H,3-4H2,1-2H3