5-phenyl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2-oxazole

Systemtic Name: 5-phenyl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2-oxazole Openeye Name: 5-phenyl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)isoxazole CAS Name: 5-phenyl-3-[(1H-1,2,4-triazol-5-ylthio)methyl]isoxazole IUPAC Name: 5-phenyl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2-oxazole Traditional Name: 5-phenyl-3-[(1H-1,2,4-triazol-5-ylthio)methyl]isoxazole Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NC=NN3

InChI

InChI=1S/C12H10N4OS/c1-2-4-9(5-3-1)11-6-10(16-17-11)7-18-12-13-8-14-15-12/h1-6,8H,7H2,(H,13,14,15)