2-(2,6-dimethylphenoxy)-N-[[4-ethyl-5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]ethanamide

Systemtic Name: 2-(2,6-dimethylphenoxy)-N-[[4-ethyl-5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: N-[[5-(2-anilino-2-oxo-ethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(2,6-dimethylphenoxy)acetamide CAS Name: N-[[5-[(2-anilino-2-oxoethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(2,6-dimethylphenoxy)acetamide IUPAC Name: N-[[5-(2-anilino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(2,6-dimethylphenoxy)acetamide Traditional Name: N-[[5-[(2-anilino-2-keto-ethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(2,6-dimethylphenoxy)acetamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CNC(=O)COC3=C(C=CC=C3C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CNC(=O)COC3=C(C=CC=C3C)C

InChI

InChI=1S/C23H27N5O3S/c1-4-28-19(13-24-20(29)14-31-22-16(2)9-8-10-17(22)3)26-27-23(28)32-15-21(30)25-18-11-6-5-7-12-18/h5-12H,4,13-15H2,1-3H3,(H,24,29)(H,25,30)