2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(furan-2-ylmethylcarbamoyl)ethanamide

Systemtic Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(furan-2-ylmethylcarbamoyl)ethanamide Openeye Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(2-furylmethylcarbamoyl)acetamide CAS Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-2-imidazolyl]thio]-N-[(2-furanylmethylamino)-oxomethyl]acetamide IUPAC Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylimidazol-2-yl]sulfanyl-N-(furan-2-ylmethylcarbamoyl)acetamide Traditional Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]thio]-N-(2-furfurylcarbamoyl)acetamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1SCC(=O)NC(=O)NCC2=CC=CO2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C(=CN=C1SCC(=O)NC(=O)NCC2=CC=CO2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H22N4O5S/c1-2-25-16(14-5-6-17-18(10-14)30-9-8-29-17)12-23-21(25)31-13-19(26)24-20(27)22-11-15-4-3-7-28-15/h3-7,10,12H,2,8-9,11,13H2,1H3,(H2,22,24,26,27)