5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylene]-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-fluorophenyl)-5-[(piperonylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H14FN3O4S MolecularWeight: 399.395563

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H14FN3O4S/c20-12-2-4-13(5-3-12)23-18(25)14(17(24)22-19(23)28)9-21-8-11-1-6-15-16(7-11)27-10-26-15/h1-7,9,21H,8,10H2,(H,22,24,28)