2-[[4-methyl-5-[(1-methylnaphthalen-2-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[4-methyl-5-[(1-methylnaphthalen-2-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[4-methyl-5-[(1-methyl-2-naphthyl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[4-methyl-5-[(1-methyl-2-naphthalenyl)oxymethyl]-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[4-methyl-5-[(1-methylnaphthalen-2-yl)oxymethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[4-methyl-5-[(1-methyl-2-naphthoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=CC=CC=C12)OCC3=NN=C(N3C)SCC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC2=CC=CC=C12)OCC3=NN=C(N3C)SCC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O2S/c1-18-21-11-7-6-10-20(21)12-13-22(18)31-16-23-27-28-25(29(23)2)32-17-24(30)26-15-14-19-8-4-3-5-9-19/h3-13H,14-17H2,1-2H3,(H,26,30)