2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[4-ethyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: N-benzyl-2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C25H26N4O2S/c1-2-29-24(22-14-9-17-31-22)26-27-25(29)32-19-23(30)28(18-21-12-7-4-8-13-21)16-15-20-10-5-3-6-11-20/h3-14,17H,2,15-16,18-19H2,1H3