1-(3,4-dimethoxyphenyl)-2-[[4-(furan-2-ylmethyl)-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(3,4-dimethoxyphenyl)-2-[[4-(furan-2-ylmethyl)-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(3,4-dimethoxyphenyl)-2-[[4-(2-furylmethyl)-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(3,4-dimethoxyphenyl)-2-[[4-(2-furanylmethyl)-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-[[4-(furan-2-ylmethyl)-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(3,4-dimethoxyphenyl)-2-[[4-(2-furfuryl)-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2CC3=CC=CO3)SCC(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2CC3=CC=CO3)SCC(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H23N3O4S/c1-16-7-4-5-9-19(16)23-25-26-24(27(23)14-18-8-6-12-31-18)32-15-20(28)17-10-11-21(29-2)22(13-17)30-3/h4-13H,14-15H2,1-3H3