4-[(5E)-5-[(5-chloranylthiophen-2-yl)methylidene]-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl]benzoate

Systemtic Name: 4-[(5E)-5-[(5-chloranylthiophen-2-yl)methylidene]-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl]benzoate Openeye Name: 4-[(5E)-5-[(5-chloro-2-thienyl)methylene]-4-oxido-6-oxo-2-thioxo-pyrimidin-1-yl]benzoate CAS Name: 4-[(5E)-5-[(5-chloro-2-thiophenyl)methylidene]-4-oxido-6-oxo-2-sulfanylidene-1-pyrimidinyl]benzoate IUPAC Name: 4-[(5E)-5-[(5-chlorothiophen-2-yl)methylidene]-4-oxido-6-oxo-2-sulfanylidenepyrimidin-1-yl]benzoate Traditional Name: 4-[(5E)-5-[(5-chloro-2-thienyl)methylene]-6-keto-4-oxido-2-thioxo-pyrimidin-1-yl]benzoate Formula: C16H7ClN2O4S2-2 MolecularWeight: 390.82078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])N2C(=O)C(=CC3=CC=C(S3)Cl)C(=NC2=S)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])N2C(=O)/C(=C/C3=CC=C(S3)Cl)/C(=NC2=S)[O-]

InChI

InChI=1S/C16H9ClN2O4S2/c17-12-6-5-10(25-12)7-11-13(20)18-16(24)19(14(11)21)9-3-1-8(2-4-9)15(22)23/h1-7H,(H,22,23)(H,18,20,24)/p-2/b11-7+