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

Systemtic Name: 3-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-isoxazole CAS Name: 3-[[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]-5-phenylisoxazole IUPAC Name: 3-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]-5-phenyl-isoxazole Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-14-7-5-6-10-17(14)25-12-19-21-20(23-22-19)27-13-16-11-18(26-24-16)15-8-3-2-4-9-15/h2-11H,12-13H2,1H3,(H,21,22,23)