ethyl 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoate

Systemtic Name: ethyl 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Openeye Name: ethyl 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]propionic acid ethyl ester Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NN=CN1C

Isomeric SMILES

CCOC(=O)C(C)SC1=NN=CN1C

InChI

InChI=1S/C8H13N3O2S/c1-4-13-7(12)6(2)14-8-10-9-5-11(8)3/h5-6H,4H2,1-3H3