N-tert-butyl-2-[[5-(naphthalen-2-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-tert-butyl-2-[[5-(naphthalen-2-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-tert-butyl-2-[[5-(2-naphthyloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-tert-butyl-2-[[5-(2-naphthalenyloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-tert-butyl-2-[[5-(naphthalen-2-yloxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[[5-(2-naphthoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N4O2S/c1-25(2,3)26-23(30)17-32-24-28-27-22(29(24)20-11-5-4-6-12-20)16-31-21-14-13-18-9-7-8-10-19(18)15-21/h4-15H,16-17H2,1-3H3,(H,26,30)