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

Systemtic Name: 3-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)isoxazole Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C18H16N4OS2/c1-2-12-5-7-13(8-6-12)17-19-18(21-20-17)25-11-14-10-15(23-22-14)16-4-3-9-24-16/h3-10H,2,11H2,1H3,(H,19,20,21)