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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4

InChI

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