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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[[5-(phenoxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[[5-(phenoxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-benzyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[[4-benzyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-N-p-anisyl-acetamide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)COC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)COC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O3S/c1-32-22-14-12-20(13-15-22)16-27-25(31)19-34-26-29-28-24(18-33-23-10-6-3-7-11-23)30(26)17-21-8-4-2-5-9-21/h2-15H,16-19H2,1H3,(H,27,31)