4-methylsulfinyl-3-phenyl-5-undecyl-1,2-oxazole

Systemtic Name: 4-methylsulfinyl-3-phenyl-5-undecyl-1,2-oxazole Openeye Name: 4-methylsulfinyl-3-phenyl-5-undecyl-isoxazole CAS Name: 4-methylsulfinyl-3-phenyl-5-undecylisoxazole IUPAC Name: 4-methylsulfinyl-3-phenyl-5-undecyl-1,2-oxazole Traditional Name: 4-methylsulfinyl-3-phenyl-5-undecyl-isoxazole Formula: C21H31NO2S MolecularWeight: 361.54134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C(C(=NO1)C2=CC=CC=C2)S(=O)C

Isomeric SMILES

CCCCCCCCCCCC1=C(C(=NO1)C2=CC=CC=C2)S(=O)C

InChI

InChI=1S/C21H31NO2S/c1-3-4-5-6-7-8-9-10-14-17-19-21(25(2)23)20(22-24-19)18-15-12-11-13-16-18/h11-13,15-16H,3-10,14,17H2,1-2H3