2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C13H12N6O3S MolecularWeight: 332.33778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C=NN=C1SCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O3S/c1-2-18-8-14-17-13(18)23-7-11-15-16-12(22-11)9-3-5-10(6-4-9)19(20)21/h3-6,8H,2,7H2,1H3