N-[1-[5-[2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)ethanamide

Systemtic Name: N-[1-[5-[2-[(2-chloranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[1-[5-[2-(2-chloro-5-nitro-anilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[1-[5-[[2-(2-chloro-5-nitroanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[1-[5-[2-(2-chloro-5-nitroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[1-[5-[[2-(2-chloro-5-nitro-anilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Formula: C22H23ClN6O5S MolecularWeight: 518.97322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)NC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23ClN6O5S/c1-13(24-19(30)10-14-4-7-16(34-3)8-5-14)21-26-27-22(28(21)2)35-12-20(31)25-18-11-15(29(32)33)6-9-17(18)23/h4-9,11,13H,10,12H2,1-3H3,(H,24,30)(H,25,31)