[5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-[(2-methylsulfanylphenoxy)methyl]isoxazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [5-[[2-(methylthio)phenoxy]methyl]-3-isoxazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-[[2-(methylthio)phenoxy]methyl]isoxazol-3-yl]-pyrrolidino-methanone Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)N3CCCC3

Isomeric SMILES

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)N3CCCC3

InChI

InChI=1S/C16H18N2O3S/c1-22-15-7-3-2-6-14(15)20-11-12-10-13(17-21-12)16(19)18-8-4-5-9-18/h2-3,6-7,10H,4-5,8-9,11H2,1H3