5-[(2-methylsulfanylphenoxy)methyl]-N-(spiro[2.5]octan-2-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(2-methylsulfanylphenoxy)methyl]-N-(spiro[2.5]octan-2-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[(2-methylsulfanylphenoxy)methyl]-N-(spiro[2.5]octan-2-ylmethyl)isoxazole-3-carboxamide CAS Name: 5-[[2-(methylthio)phenoxy]methyl]-N-(2-spiro[2.5]octanylmethyl)-3-isoxazolecarboxamide IUPAC Name: 5-[(2-methylsulfanylphenoxy)methyl]-N-(spiro[2.5]octan-2-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[[2-(methylthio)phenoxy]methyl]-N-(spiro[2.5]octan-2-ylmethyl)isoxazole-3-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)NCC3CC34CCCCC4

Isomeric SMILES

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)NCC3CC34CCCCC4

InChI

InChI=1S/C21H26N2O3S/c1-27-19-8-4-3-7-18(19)25-14-16-11-17(23-26-16)20(24)22-13-15-12-21(15)9-5-2-6-10-21/h3-4,7-8,11,15H,2,5-6,9-10,12-14H2,1H3,(H,22,24)