2-[[5-cyano-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[[5-cyano-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[[5-cyano-6-(2-furyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[[5-cyano-6-(2-furanyl)-4-oxo-1H-pyrimidin-2-yl]thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[[5-cyano-6-(furan-2-yl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[[5-cyano-6-(2-furyl)-4-keto-1H-pyrimidin-2-yl]thio]-N-(3-nitrophenyl)acetamide Formula: C17H11N5O5S MolecularWeight: 397.36474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=O)C(=C(N2)C3=CC=CO3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=O)C(=C(N2)C3=CC=CO3)C#N

InChI

InChI=1S/C17H11N5O5S/c18-8-12-15(13-5-2-6-27-13)20-17(21-16(12)24)28-9-14(23)19-10-3-1-4-11(7-10)22(25)26/h1-7H,9H2,(H,19,23)(H,20,21,24)