N-(4-chloranyl-2-nitro-phenyl)-2-[[5-cyano-6-(2-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-[[5-cyano-6-(2-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-[[5-cyano-6-(2-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[[5-cyano-6-(2-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-[[5-cyano-6-(2-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-[[5-cyano-4-keto-6-(2-methoxyphenyl)-1H-pyrimidin-2-yl]thio]acetamide Formula: C20H14ClN5O5S MolecularWeight: 471.87366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(C(=O)N=C(N2)SCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=CC=C1C2=C(C(=O)N=C(N2)SCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H14ClN5O5S/c1-31-16-5-3-2-4-12(16)18-13(9-22)19(28)25-20(24-18)32-10-17(27)23-14-7-6-11(21)8-15(14)26(29)30/h2-8H,10H2,1H3,(H,23,27)(H,24,25,28)