N-[2-[[3-[3,5-bis(chloranyl)-2,4,6-trimethyl-phenyl]-1,2-oxazol-5-yl]methylsulfonyl]phenyl]ethanamide

Systemtic Name: N-[2-[[3-[3,5-bis(chloranyl)-2,4,6-trimethyl-phenyl]-1,2-oxazol-5-yl]methylsulfonyl]phenyl]ethanamide Openeye Name: N-[2-[[3-(3,5-dichloro-2,4,6-trimethyl-phenyl)isoxazol-5-yl]methylsulfonyl]phenyl]acetamide CAS Name: N-[2-[[3-(3,5-dichloro-2,4,6-trimethylphenyl)-5-isoxazolyl]methylsulfonyl]phenyl]acetamide IUPAC Name: N-[2-[[3-(3,5-dichloro-2,4,6-trimethylphenyl)-1,2-oxazol-5-yl]methylsulfonyl]phenyl]acetamide Traditional Name: N-[2-[[3-(3,5-dichloro-2,4,6-trimethyl-phenyl)isoxazol-5-yl]methylsulfonyl]phenyl]acetamide Formula: C21H20Cl2N2O4S MolecularWeight: 467.3655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1Cl)C)Cl)C)C2=NOC(=C2)CS(=O)(=O)C3=CC=CC=C3NC(=O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1Cl)C)Cl)C)C2=NOC(=C2)CS(=O)(=O)C3=CC=CC=C3NC(=O)C

InChI

InChI=1S/C21H20Cl2N2O4S/c1-11-19(12(2)21(23)13(3)20(11)22)17-9-15(29-25-17)10-30(27,28)18-8-6-5-7-16(18)24-14(4)26/h5-9H,10H2,1-4H3,(H,24,26)