N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: 2-[[4-keto-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]-N-piperonyl-acetamide Formula: C15H12F3N3O4S MolecularWeight: 387.33369

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC(=O)C=C(N3)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC(=O)C=C(N3)C(F)(F)F

InChI

InChI=1S/C15H12F3N3O4S/c16-15(17,18)11-4-12(22)21-14(20-11)26-6-13(23)19-5-8-1-2-9-10(3-8)25-7-24-9/h1-4H,5-7H2,(H,19,23)(H,20,21,22)