1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(pyridin-3-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(pyridin-3-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(3-pyridylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-[(3-pyridinylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-[(pyridin-3-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(3-pyridylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H10ClFN4O2S MolecularWeight: 376.792603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC(=CN=C1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H10ClFN4O2S/c17-12-6-10(3-4-13(12)18)22-15(24)11(14(23)21-16(22)25)8-20-9-2-1-5-19-7-9/h1-8,20H,(H,21,23,25)