N-tert-butyl-2-[[4-ethyl-5-(quinolin-8-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-tert-butyl-2-[[4-ethyl-5-(quinolin-8-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-tert-butyl-2-[[4-ethyl-5-(8-quinolyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-tert-butyl-2-[[4-ethyl-5-(8-quinolinyloxymethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-tert-butyl-2-[[4-ethyl-5-(quinolin-8-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[[4-ethyl-5-(8-quinolyloxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(C)(C)C)COC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(C)(C)C)COC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C20H25N5O2S/c1-5-25-16(23-24-19(25)28-13-17(26)22-20(2,3)4)12-27-15-10-6-8-14-9-7-11-21-18(14)15/h6-11H,5,12-13H2,1-4H3,(H,22,26)