5-[[(3-chlorophenyl)amino]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[(3-chlorophenyl)amino]methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-chloroanilino)methylene]-1-ethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-chloroanilino)methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-chloroanilino)methylidene]-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(3-chloroanilino)methylene]-1-ethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H12ClN3O2S MolecularWeight: 309.77128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CNC2=CC(=CC=C2)Cl)C(=O)NC1=S

Isomeric SMILES

CCN1C(=O)C(=CNC2=CC(=CC=C2)Cl)C(=O)NC1=S

InChI

InChI=1S/C13H12ClN3O2S/c1-2-17-12(19)10(11(18)16-13(17)20)7-15-9-5-3-4-8(14)6-9/h3-7,15H,2H2,1H3,(H,16,18,20)