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

Systemtic Name: ethyl 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NNC(=N1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CSC1=NNC(=N1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14N4O3S/c1-2-20-10(18)8-21-13-15-12(16-17-13)14-11(19)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,14,15,16,17,19)