5-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-thiophen-3-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-thiophen-3-yl-1,2,4-oxadiazole Openeye Name: 5-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(3-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-3-(3-thiophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-thiophen-3-yl-1,2,4-oxadiazole Traditional Name: 5-[[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-3-(3-thienyl)-1,2,4-oxadiazole Formula: C20H21N5OS2 MolecularWeight: 411.54364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C20H21N5OS2/c1-20(2,3)15-7-5-13(6-8-15)18-22-23-19(25(18)4)28-12-16-21-17(24-26-16)14-9-10-27-11-14/h5-11H,12H2,1-4H3