N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenethylsulfanyl-ethanamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenethylsulfanyl-ethanamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-2-phenethylsulfanyl-acetamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-2-(phenethylthio)acetamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenethylsulfanylacetamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-2-(phenethylthio)acetamide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CSC(=N3)NC(=O)CSCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CSC(=N3)NC(=O)CSCCC4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3S2/c24-20(14-27-11-8-15-4-2-1-3-5-15)23-21-22-17(13-28-21)16-6-7-18-19(12-16)26-10-9-25-18/h1-7,12-13H,8-11,14H2,(H,22,23,24)