1-[2-oxidanyl-3-propyl-4-[2-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)ethoxymethyl]phenyl]ethanone

Systemtic Name: 1-[2-oxidanyl-3-propyl-4-[2-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)ethoxymethyl]phenyl]ethanone Openeye Name: 1-[2-hydroxy-3-propyl-4-[2-(2H-tetrazol-5-ylsulfanyl)ethoxymethyl]phenyl]ethanone CAS Name: 1-[2-hydroxy-3-propyl-4-[2-(2H-tetrazol-5-ylthio)ethoxymethyl]phenyl]ethanone IUPAC Name: 1-[2-hydroxy-3-propyl-4-[2-(2H-tetrazol-5-ylsulfanyl)ethoxymethyl]phenyl]ethanone Traditional Name: 1-[2-hydroxy-3-propyl-4-[2-(2H-tetrazol-5-ylthio)ethoxymethyl]phenyl]ethanone Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COCCSC2=NNN=N2

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COCCSC2=NNN=N2

InChI

InChI=1S/C15H20N4O3S/c1-3-4-13-11(5-6-12(10(2)20)14(13)21)9-22-7-8-23-15-16-18-19-17-15/h5-6,21H,3-4,7-9H2,1-2H3,(H,16,17,18,19)