N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-phenyl-acetamide Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)N(CC#N)C3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)N(CC#N)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3S/c19-8-9-20(14-4-2-1-3-5-14)18(21)13-24-15-6-7-16-17(12-15)23-11-10-22-16/h1-7,12H,9-11,13H2