2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1H-pyrazol-4-yl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1H-pyrazol-4-yl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1H-pyrazol-4-yl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(1H-pyrazol-4-yl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1H-pyrazol-4-yl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(1H-pyrazol-4-yl)acetamide Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)NC3=CNN=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)NC3=CNN=C3

InChI

InChI=1S/C13H13N3O3S/c17-13(16-9-6-14-15-7-9)8-20-10-1-2-11-12(5-10)19-4-3-18-11/h1-2,5-7H,3-4,8H2,(H,14,15)(H,16,17)