N3-[4-chloranyl-2-(2-chloranyl-4,6-dimethyl-phenyl)-3-methyl-5H-1,2-oxazol-5-yl]thiophene-2,3-disulfonamide

Systemtic Name: N3-[4-chloranyl-2-(2-chloranyl-4,6-dimethyl-phenyl)-3-methyl-5H-1,2-oxazol-5-yl]thiophene-2,3-disulfonamide Openeye Name: N3-[4-chloro-2-(2-chloro-4,6-dimethyl-phenyl)-3-methyl-5H-isoxazol-5-yl]thiophene-2,3-disulfonamide CAS Name: N3-[4-chloro-2-(2-chloro-4,6-dimethylphenyl)-3-methyl-5H-isoxazol-5-yl]thiophene-2,3-disulfonamide IUPAC Name: 3-N-[4-chloro-2-(2-chloro-4,6-dimethylphenyl)-3-methyl-5H-1,2-oxazol-5-yl]thiophene-2,3-disulfonamide Traditional Name: N'-[4-chloro-2-(2-chloro-4,6-dimethyl-phenyl)-3-methyl-3-isoxazolin-5-yl]thiophene-2,3-disulfonamide Formula: C16H17Cl2N3O5S3 MolecularWeight: 498.42428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)N2C(=C(C(O2)NS(=O)(=O)C3=C(SC=C3)S(=O)(=O)N)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)N2C(=C(C(O2)NS(=O)(=O)C3=C(SC=C3)S(=O)(=O)N)Cl)C)C

InChI

InChI=1S/C16H17Cl2N3O5S3/c1-8-6-9(2)14(11(17)7-8)21-10(3)13(18)15(26-21)20-29(24,25)12-4-5-27-16(12)28(19,22)23/h4-7,15,20H,1-3H3,(H2,19,22,23)