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

Systemtic Name: 3-[5-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-ethyl-5-[(2-keto-2-p-phenetyl-ethyl)thio]-1,2,4-triazol-3-yl]propionamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3S/c1-3-21-16(10-9-15(18)23)19-20-17(21)25-11-14(22)12-5-7-13(8-6-12)24-4-2/h5-8H,3-4,9-11H2,1-2H3,(H2,18,23)