(5Z)-1-(4-chlorophenyl)-5-[(2-methyl-4-nitro-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-1-(4-chlorophenyl)-5-[(2-methyl-4-nitro-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-(4-chlorophenyl)-5-[(2-methyl-4-nitro-phenyl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-1-(4-chlorophenyl)-5-[(2-methyl-4-nitrophenyl)methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-1-(4-chlorophenyl)-5-[(2-methyl-4-nitrophenyl)methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-1-(4-chlorophenyl)-6-keto-5-(2-methyl-4-nitro-benzylidene)-2-thioxo-pyrimidin-4-olate Formula: C18H11ClN3O4S- MolecularWeight: 400.81564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C=C2C(=NC(=S)N(C2=O)C3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])/C=C\2/C(=NC(=S)N(C2=O)C3=CC=C(C=C3)Cl)[O-]

InChI

InChI=1S/C18H12ClN3O4S/c1-10-8-14(22(25)26)5-2-11(10)9-15-16(23)20-18(27)21(17(15)24)13-6-3-12(19)4-7-13/h2-9H,1H3,(H,20,23,27)/p-1/b15-9-