ethyl 4-[[5-(1,5-dimethylpyrazol-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[5-(1,5-dimethylpyrazol-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[5-(1,5-dimethylpyrazol-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[5-(1,5-dimethyl-3-pyrazolyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(1,5-dimethylpyrazol-3-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-3-oxobutanoate Traditional Name: 4-[[5-(1,5-dimethylpyrazol-3-yl)-4-ethyl-1,2,4-triazol-3-yl]thio]-3-keto-butyric acid ethyl ester Formula: C15H21N5O3S MolecularWeight: 351.42394

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)CC(=O)OCC)C2=NN(C(=C2)C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)CC(=O)OCC)C2=NN(C(=C2)C)C

InChI

InChI=1S/C15H21N5O3S/c1-5-20-14(12-7-10(3)19(4)18-12)16-17-15(20)24-9-11(21)8-13(22)23-6-2/h7H,5-6,8-9H2,1-4H3