4-bromanyl-3-[(2-chloranyl-4-methylsulfonyl-phenyl)methyl]-5-cyclopropyl-1,2-oxazole

Systemtic Name: 4-bromanyl-3-[(2-chloranyl-4-methylsulfonyl-phenyl)methyl]-5-cyclopropyl-1,2-oxazole Openeye Name: 4-bromo-3-[(2-chloro-4-methylsulfonyl-phenyl)methyl]-5-cyclopropyl-isoxazole CAS Name: 4-bromo-3-[(2-chloro-4-methylsulfonylphenyl)methyl]-5-cyclopropylisoxazole IUPAC Name: 4-bromo-3-[(2-chloro-4-methylsulfonylphenyl)methyl]-5-cyclopropyl-1,2-oxazole Traditional Name: 4-bromo-3-(2-chloro-4-mesyl-benzyl)-5-cyclopropyl-isoxazole Formula: C14H13BrClNO3S MolecularWeight: 390.67992

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)CC2=NOC(=C2Br)C3CC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)CC2=NOC(=C2Br)C3CC3)Cl

InChI

InChI=1S/C14H13BrClNO3S/c1-21(18,19)10-5-4-9(11(16)7-10)6-12-13(15)14(20-17-12)8-2-3-8/h4-5,7-8H,2-3,6H2,1H3