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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

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