2-[[5-(naphthalen-1-yloxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(naphthalen-1-yloxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(1-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(1-naphthalenyloxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-benzyl-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-benzyl-5-(1-naphthoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)N)COC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)N)COC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N4O2S/c23-20(27)15-29-22-25-24-21(26(22)13-16-7-2-1-3-8-16)14-28-19-12-6-10-17-9-4-5-11-18(17)19/h1-12H,13-15H2,(H2,23,27)