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

Systemtic Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylene]-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-phenyl-5-[(piperonylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H15N3O4S MolecularWeight: 381.4051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N3O4S/c23-17-14(10-20-9-12-6-7-15-16(8-12)26-11-25-15)18(24)22(19(27)21-17)13-4-2-1-3-5-13/h1-8,10,20H,9,11H2,(H,21,23,27)