ethyl 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-ethoxy-4-phenyl-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(N1C2=CC=CC=C2)SCC(=O)OCC

Isomeric SMILES

CCOC1=NN=C(N1C2=CC=CC=C2)SCC(=O)OCC

InChI

InChI=1S/C14H17N3O3S/c1-3-19-12(18)10-21-14-16-15-13(20-4-2)17(14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3