(5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-allyl-5-[[5-(3-nitrophenyl)-2-furyl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[[5-(3-nitrophenyl)-2-furanyl]methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-1-allyl-6-keto-5-[[5-(3-nitrophenyl)-2-furyl]methylene]-2-thioxo-pyrimidin-4-olate Formula: C18H12N3O5S- MolecularWeight: 382.36998

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C(=NC1=S)[O-]

Isomeric SMILES

C=CCN1C(=O)/C(=C\C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])/C(=NC1=S)[O-]

InChI

InChI=1S/C18H13N3O5S/c1-2-8-20-17(23)14(16(22)19-18(20)27)10-13-6-7-15(26-13)11-4-3-5-12(9-11)21(24)25/h2-7,9-10H,1,8H2,(H,19,22,27)/p-1/b14-10-