N-[[4-ethyl-5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-ethyl-5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-ethyl-5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-ethyl-5-[[2-oxo-2-(phenethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-ethyl-5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[4-ethyl-5-[[2-keto-2-(phenethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Formula: C20H23N5O2S2 MolecularWeight: 429.55892

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)CNC(=O)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C20H23N5O2S2/c1-2-25-17(13-22-19(27)16-9-6-12-28-16)23-24-20(25)29-14-18(26)21-11-10-15-7-4-3-5-8-15/h3-9,12H,2,10-11,13-14H2,1H3,(H,21,26)(H,22,27)