4-[2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[2-(4,5-dimethyloxazol-2-yl)sulfanyl-5-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[2-[(4,5-dimethyl-2-oxazolyl)thio]-5-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[2-[(4,5-dimethyloxazol-2-yl)thio]-5-nitro-phenyl]sulfonylmorpholine Formula: C15H17N3O6S2 MolecularWeight: 399.44198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(OC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C15H17N3O6S2/c1-10-11(2)24-15(16-10)25-13-4-3-12(18(19)20)9-14(13)26(21,22)17-5-7-23-8-6-17/h3-4,9H,5-8H2,1-2H3