[4-bromanyl-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropyl-1,2-oxazol-3-yl)methanone

Systemtic Name: [4-bromanyl-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropyl-1,2-oxazol-3-yl)methanone Openeye Name: [4-bromo-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropylisoxazol-3-yl)methanone CAS Name: [4-bromo-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropyl-3-isoxazolyl)methanone IUPAC Name: [4-bromo-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropyl-1,2-oxazol-3-yl)methanone Traditional Name: [4-bromo-2-(tert-butylsulfonylmethyl)phenyl]-(5-cyclopropylisoxazol-3-yl)methanone Formula: C18H20BrNO4S MolecularWeight: 426.3247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)CC1=C(C=CC(=C1)Br)C(=O)C2=NOC(=C2)C3CC3

Isomeric SMILES

CC(C)(C)S(=O)(=O)CC1=C(C=CC(=C1)Br)C(=O)C2=NOC(=C2)C3CC3

InChI

InChI=1S/C18H20BrNO4S/c1-18(2,3)25(22,23)10-12-8-13(19)6-7-14(12)17(21)15-9-16(24-20-15)11-4-5-11/h6-9,11H,4-5,10H2,1-3H3