2-[[2-(furan-2-ylcarbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[[2-(furan-2-ylcarbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-[[2-(furan-2-carbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[[2-[2-furanyl(oxo)methyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[[2-(furan-2-carbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[[2-(2-furoyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C22H17N5O6S MolecularWeight: 479.46528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N5O6S/c1-32-18-12-15(27(30)31)9-10-16(18)23-19(28)13-34-22-24-20(14-6-3-2-4-7-14)25-26(22)21(29)17-8-5-11-33-17/h2-12H,13H2,1H3,(H,23,28)