N-[4-fluoranyl-3-(2-methylsulfanylethanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-fluoranyl-3-(2-methylsulfanylethanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-fluoro-3-[(2-methylsulfanylacetyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-fluoro-3-[[2-(methylthio)-1-oxoethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-fluoro-3-[(2-methylsulfanylacetyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-fluoro-3-[[2-(methylthio)acetyl]amino]phenyl]-piperonylamide Formula: C17H15FN2O4S MolecularWeight: 362.375403

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CSCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C17H15FN2O4S/c1-25-8-16(21)20-13-7-11(3-4-12(13)18)19-17(22)10-2-5-14-15(6-10)24-9-23-14/h2-7H,8-9H2,1H3,(H,19,22)(H,20,21)