4-chloranyl-3,6-bis(oxidanylidene)-5-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)cyclohexa-1,4-diene-1,2-dicarbonitrile

Systemtic Name: 4-chloranyl-3,6-bis(oxidanylidene)-5-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)cyclohexa-1,4-diene-1,2-dicarbonitrile Openeye Name: 4-chloro-5-(6-hydroxy-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-3,6-dioxo-cyclohexa-1,4-diene-1,2-dicarbonitrile CAS Name: 4-chloro-5-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile IUPAC Name: 4-chloro-5-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile Traditional Name: 4-chloro-5-(6-hydroxy-4-keto-2-thioxo-1H-pyrimidin-5-yl)-3,6-diketo-cyclohexa-1,4-diene-1,2-dicarbonitrile Formula: C12H3ClN4O4S MolecularWeight: 334.69462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(#N)C1=C(C(=O)C(=C(C1=O)C2=C(NC(=S)NC2=O)O)Cl)C#N

Isomeric SMILES

C(#N)C1=C(C(=O)C(=C(C1=O)C2=C(NC(=S)NC2=O)O)Cl)C#N

InChI

InChI=1S/C12H3ClN4O4S/c13-7-5(6-10(20)16-12(22)17-11(6)21)8(18)3(1-14)4(2-15)9(7)19/h(H3,16,17,20,21,22)