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

Systemtic Name: 3-[5-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(2,5-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[2-(2,5-dimethoxyphenyl)-2-oxoethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-(2,5-dimethoxyphenyl)-2-keto-ethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]propionamide Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=C(C=CC(=C2)OC)OC)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=C(C=CC(=C2)OC)OC)CCC(=O)N

InChI

InChI=1S/C17H22N4O4S/c1-4-21-16(8-7-15(18)23)19-20-17(21)26-10-13(22)12-9-11(24-2)5-6-14(12)25-3/h5-6,9H,4,7-8,10H2,1-3H3,(H2,18,23)