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

Systemtic Name: ethyl 6-[[4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[[4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate CAS Name: 6-[[4-ethyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carboxylate Traditional Name: 6-[[4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]nicotinic acid ethyl ester Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O3S/c1-4-21-15(13-8-9-24-11(13)3)19-20-17(21)25-14-7-6-12(10-18-14)16(22)23-5-2/h6-10H,4-5H2,1-3H3