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.alpha.-[3'-(Phenyl)isoxazolyl]-.alpha.-(Z)-sulfinyl-N-(4-methylphenylsulfonyl)morpholinoacetamidin
SpectraBase Compound ID 76VymC9Br79
InChI InChI=1S/C22H21N3O5S2/c1-16-7-9-18(10-8-16)32(27,28)24-22(25-11-13-29-14-12-25)21(31-26)20-15-19(23-30-20)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3/b24-22-
InChIKey VXNAGEDFNWRKCS-GYHWCHFESA-N
Mol Weight 471.55 g/mol
Molecular Formula C22H21N3O5S2
Exact Mass 471.092263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrNawIjkbid
Name .alpha.-[3'-(Phenyl)isoxazolyl]-.alpha.-(Z)-sulfinyl-N-(4-methylphenylsulfonyl)morpholinoacetamidin
Alternate Name(s) .alpha.-[3'-(Phenyl)isoxazolyl]-.alpha.-(E)-sulfinyl-N-(4-methylphenylsulfonyl)morpholinoacetamidin (NZ)-4-methyl-N-[1-(4-morpholinyl)-2-(3-phenyl-5-isoxazolyl)-2-sulfinylethylidene]benzenesulfonamide (NZ)-4-methyl-N-[1-morpholin-4-yl-2-(3-phenyl-1,2-oxazol-5-yl)-2-sulfinyl-ethylidene]benzenesulfonamide (NZ)-4-methyl-N-[1-morpholino-2-(3-phenylisoxazol-5-yl)-2-sulfinyl-ethylidene]benzenesulfonamide 4-Methyl-N-[(Z)-1-(4-morpholinyl)-2-(3-phenyl-5-isoxazolyl)-2-sulfinylethylidene]benzenesulfonamide
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Formula C22H21N3O5S2
InChI InChI=1S/C22H21N3O5S2/c1-16-7-9-18(10-8-16)32(27,28)24-22(25-11-13-29-14-12-25)21(31-26)20-15-19(23-30-20)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3/b24-22-
InChIKey VXNAGEDFNWRKCS-GYHWCHFESA-N
Molecular Weight 471.546 g/mol
SMILES c1cc(-c2cc(on2)C(\C(N2CCOCC2)=N\S(=O)(=O)c2ccc(cc2)C)=S=O)ccc1
SPLASH splash10-0006-5933000000-fe7e2f76c1c95b2291a3
Wiley ID 1498357