(5E)-5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-methyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-methyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-5-[[4-(4-chlorophenyl)sulfanylphenyl]methylene]-1-methyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[[4-[(4-chlorophenyl)thio]phenyl]methylidene]-1-methyl-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-methyl-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-5-[4-[(4-chlorophenyl)thio]benzylidene]-6-keto-1-methyl-2-thioxo-pyrimidin-4-olate Formula: C18H12ClN2O2S2- MolecularWeight: 387.88308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)C(=NC1=S)[O-]

Isomeric SMILES

CN1C(=O)/C(=C/C2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)/C(=NC1=S)[O-]

InChI

InChI=1S/C18H13ClN2O2S2/c1-21-17(23)15(16(22)20-18(21)24)10-11-2-6-13(7-3-11)25-14-8-4-12(19)5-9-14/h2-10H,1H3,(H,20,22,24)/p-1/b15-10+