2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC(=NN2)SCC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC(=NN2)SCC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N4O2S/c1-15-7-2-5-12-19(15)28-13-20-24-22(26-25-20)29-14-21(27)23-18-11-6-9-16-8-3-4-10-17(16)18/h2-12H,13-14H2,1H3,(H,23,27)(H,24,25,26)