N-[2-(phenylmethylsulfanyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[2-(phenylmethylthio)ethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c20-18(15-6-7-16-17(12-15)22-10-9-21-16)19-8-11-23-13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,19,20)