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

Systemtic Name: (2-chloranyl-4-methylsulfonyl-phenyl)-(5-cyclopropyl-3-methylsulfanyl-1,2-oxazol-4-yl)methanone Openeye Name: (2-chloro-4-methylsulfonyl-phenyl)-(5-cyclopropyl-3-methylsulfanyl-isoxazol-4-yl)methanone CAS Name: (2-chloro-4-methylsulfonylphenyl)-[5-cyclopropyl-3-(methylthio)-4-isoxazolyl]methanone IUPAC Name: (2-chloro-4-methylsulfonylphenyl)-(5-cyclopropyl-3-methylsulfanyl-1,2-oxazol-4-yl)methanone Traditional Name: (2-chloro-4-mesyl-phenyl)-[5-cyclopropyl-3-(methylthio)isoxazol-4-yl]methanone Formula: C15H14ClNO4S2 MolecularWeight: 371.85896

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NOC(=C1C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl)C3CC3

Isomeric SMILES

CSC1=NOC(=C1C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl)C3CC3

InChI

InChI=1S/C15H14ClNO4S2/c1-22-15-12(14(21-17-15)8-3-4-8)13(18)10-6-5-9(7-11(10)16)23(2,19)20/h5-8H,3-4H2,1-2H3