N-[1-[4-ethyl-5-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-2-methoxy-benzamide

Systemtic Name: N-[1-[4-ethyl-5-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-2-methoxy-benzamide Openeye Name: N-[1-[4-ethyl-5-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-methoxy-benzamide CAS Name: N-[1-[4-ethyl-5-[[2-(3-nitrophenyl)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-methoxybenzamide IUPAC Name: N-[1-[4-ethyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-2-methoxybenzamide Traditional Name: N-[1-[4-ethyl-5-[[2-keto-2-(3-nitrophenyl)ethyl]thio]-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-2-methoxy-benzamide Formula: C22H23N5O6S MolecularWeight: 485.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(CO)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(CO)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H23N5O6S/c1-3-26-20(17(12-28)23-21(30)16-9-4-5-10-19(16)33-2)24-25-22(26)34-13-18(29)14-7-6-8-15(11-14)27(31)32/h4-11,17,28H,3,12-13H2,1-2H3,(H,23,30)