2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenylmethoxyphenyl)ethanamide

Systemtic Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenylmethoxyphenyl)ethanamide Openeye Name: N-(4-benzyloxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]-N-(4-phenylmethoxyphenyl)acetamide IUPAC Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenylmethoxyphenyl)acetamide Traditional Name: N-(4-benzoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CCC2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1CCC2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2S/c1-20-28-29-26(30(20)17-16-21-8-4-2-5-9-21)33-19-25(31)27-23-12-14-24(15-13-23)32-18-22-10-6-3-7-11-22/h2-15H,16-19H2,1H3,(H,27,31)