2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[[2-(phenoxymethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[[2-(phenoxymethyl)phenyl]methyl]ethanamide Openeye Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide CAS Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide IUPAC Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide Traditional Name: 2-[[4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-N-[2-(phenoxymethyl)benzyl]acetamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=NN=C2SCC(=O)NCC3=CC=CC=C3COC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=NN=C2SCC(=O)NCC3=CC=CC=C3COC4=CC=CC=C4)C

InChI

InChI=1S/C26H26N4O2S/c1-19-12-13-23(14-20(19)2)30-18-28-29-26(30)33-17-25(31)27-15-21-8-6-7-9-22(21)16-32-24-10-4-3-5-11-24/h3-14,18H,15-17H2,1-2H3,(H,27,31)