3-(2,5-dimethoxyphenyl)-5-[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2,5-dimethoxyphenyl)-5-[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 5-[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(2,5-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 3-(2,5-dimethoxyphenyl)-5-[[[4-(3,4-dimethylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-1,2,4-oxadiazole IUPAC Name: 5-[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(2,5-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[[5-benzyl-4-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-3-(2,5-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C28H27N5O3S MolecularWeight: 513.61068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NN=C2SCC3=NC(=NO3)C4=C(C=CC(=C4)OC)OC)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NN=C2SCC3=NC(=NO3)C4=C(C=CC(=C4)OC)OC)CC5=CC=CC=C5)C

InChI

InChI=1S/C28H27N5O3S/c1-18-10-11-21(14-19(18)2)33-25(15-20-8-6-5-7-9-20)30-31-28(33)37-17-26-29-27(32-36-26)23-16-22(34-3)12-13-24(23)35-4/h5-14,16H,15,17H2,1-4H3