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

Systemtic Name: 2-[[5-(naphthalen-1-yloxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[4-benzyl-5-(1-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[5-(1-naphthalenyloxymethyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[4-benzyl-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[4-benzyl-5-(1-naphthoxymethyl)-1,2,4-triazol-3-yl]thio]-1-pyrrolidino-ethanone Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NN=C(N2CC3=CC=CC=C3)COC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NN=C(N2CC3=CC=CC=C3)COC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H26N4O2S/c31-25(29-15-6-7-16-29)19-33-26-28-27-24(30(26)17-20-9-2-1-3-10-20)18-32-23-14-8-12-21-11-4-5-13-22(21)23/h1-5,8-14H,6-7,15-19H2