(4-bromanyl-3-methylsulfanyl-2-methylsulfonyl-phenyl)-(5-cyclopropyl-1,2-oxazol-3-yl)methanone

Systemtic Name: (4-bromanyl-3-methylsulfanyl-2-methylsulfonyl-phenyl)-(5-cyclopropyl-1,2-oxazol-3-yl)methanone Openeye Name: (4-bromo-3-methylsulfanyl-2-methylsulfonyl-phenyl)-(5-cyclopropylisoxazol-3-yl)methanone CAS Name: [4-bromo-2-methylsulfonyl-3-(methylthio)phenyl]-(5-cyclopropyl-3-isoxazolyl)methanone IUPAC Name: (4-bromo-3-methylsulfanyl-2-methylsulfonylphenyl)-(5-cyclopropyl-1,2-oxazol-3-yl)methanone Traditional Name: [4-bromo-2-mesyl-3-(methylthio)phenyl]-(5-cyclopropylisoxazol-3-yl)methanone Formula: C15H14BrNO4S2 MolecularWeight: 416.30996

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1S(=O)(=O)C)C(=O)C2=NOC(=C2)C3CC3)Br

Isomeric SMILES

CSC1=C(C=CC(=C1S(=O)(=O)C)C(=O)C2=NOC(=C2)C3CC3)Br

InChI

InChI=1S/C15H14BrNO4S2/c1-22-14-10(16)6-5-9(15(14)23(2,19)20)13(18)11-7-12(21-17-11)8-3-4-8/h5-8H,3-4H2,1-2H3