2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-1-phenylethanone IUPAC Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone Traditional Name: 2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-1-phenyl-ethanone Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC(=NN2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC(=NN2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-13-7-5-6-10-16(13)23-11-17-19-18(21-20-17)24-12-15(22)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H,19,20,21)