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

Systemtic Name: 5-phenyl-3-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2-oxazole Openeye Name: 5-phenyl-3-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]isoxazole CAS Name: 5-phenyl-3-[[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]isoxazole IUPAC Name: 5-phenyl-3-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2-oxazole Traditional Name: 5-phenyl-3-[[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]isoxazole Formula: C17H14N4OS2 MolecularWeight: 354.44926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NNC(=N3)CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NNC(=N3)CC4=CC=CS4

InChI

InChI=1S/C17H14N4OS2/c1-2-5-12(6-3-1)15-9-13(21-22-15)11-24-17-18-16(19-20-17)10-14-7-4-8-23-14/h1-9H,10-11H2,(H,18,19,20)