(2R)-5-cyano-2-[5-(2-nitrophenyl)furan-2-yl]-3-phenyl-4-sulfanylidene-1,2-dihydropyrimidin-6-olate

Systemtic Name: (2R)-5-cyano-2-[5-(2-nitrophenyl)furan-2-yl]-3-phenyl-4-sulfanylidene-1,2-dihydropyrimidin-6-olate Openeye Name: (2R)-5-cyano-2-[5-(2-nitrophenyl)-2-furyl]-3-phenyl-4-thioxo-1,2-dihydropyrimidin-6-olate CAS Name: (2R)-5-cyano-2-[5-(2-nitrophenyl)-2-furanyl]-3-phenyl-4-sulfanylidene-1,2-dihydropyrimidin-6-olate IUPAC Name: (2R)-5-cyano-2-[5-(2-nitrophenyl)furan-2-yl]-3-phenyl-4-sulfanylidene-1,2-dihydropyrimidin-6-olate Traditional Name: (2R)-5-cyano-2-[5-(2-nitrophenyl)-2-furyl]-3-phenyl-4-thioxo-1,2-dihydropyrimidin-6-olate Formula: C21H13N4O4S- MolecularWeight: 417.41732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(NC(=C(C2=S)C#N)[O-])C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2[C@@H](NC(=C(C2=S)C#N)[O-])C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O4S/c22-12-15-20(26)23-19(24(21(15)30)13-6-2-1-3-7-13)18-11-10-17(29-18)14-8-4-5-9-16(14)25(27)28/h1-11,19,23,26H/p-1/t19-/m1/s1