2-(1-adamantylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-(1-adamantylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-(1-adamantylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-(1-adamantylthio)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-(1-adamantylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-(1-adamantylthio)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H25NO3S/c22-19(21-16-1-2-17-18(8-16)24-4-3-23-17)12-25-20-9-13-5-14(10-20)7-15(6-13)11-20/h1-2,8,13-15H,3-7,9-12H2,(H,21,22)