N-(2,6-dimethylphenyl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[[4-(2-furylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[4-(2-furanylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[4-(2-furfuryl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=C(C=CC=C4C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=C(C=CC=C4C)C

InChI

InChI=1S/C25H26N4O3S/c1-17-9-11-20(12-10-17)32-15-22-27-28-25(29(22)14-21-8-5-13-31-21)33-16-23(30)26-24-18(2)6-4-7-19(24)3/h4-13H,14-16H2,1-3H3,(H,26,30)