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

Systemtic Name: ethyl 6-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[[5-(2-furylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carboxylate CAS Name: 6-[[5-(2-furanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]pyridine-3-carboxylate Traditional Name: 6-[[5-(2-furfurylamino)-1,3,4-thiadiazol-2-yl]thio]nicotinic acid ethyl ester Formula: C15H14N4O3S2 MolecularWeight: 362.42666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)SC2=NN=C(S2)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)SC2=NN=C(S2)NCC3=CC=CO3

InChI

InChI=1S/C15H14N4O3S2/c1-2-21-13(20)10-5-6-12(16-8-10)23-15-19-18-14(24-15)17-9-11-4-3-7-22-11/h3-8H,2,9H2,1H3,(H,17,18)