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

Systemtic Name: 2-[[4-(2-ethoxyphenyl)-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[4-(2-ethoxyphenyl)-5-(1-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[4-(2-ethoxyphenyl)-5-(1-naphthalenyloxymethyl)-1,2,4-triazol-3-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[4-(2-ethoxyphenyl)-5-(naphthalen-1-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-(1-naphthoxymethyl)-4-o-phenetyl-1,2,4-triazol-3-yl]thio]-1-pyrrolidino-ethanone Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCCC3)COC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCCC3)COC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H28N4O3S/c1-2-33-24-14-6-5-13-22(24)31-25(18-34-23-15-9-11-20-10-3-4-12-21(20)23)28-29-27(31)35-19-26(32)30-16-7-8-17-30/h3-6,9-15H,2,7-8,16-19H2,1H3