3,5-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)isoxazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-isoxazolesulfonamide IUPAC Name: 3,5-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-4-sulfonamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3,5-dimethyl-isoxazole-4-sulfonamide Formula: C13H13N3O5S3 MolecularWeight: 387.45442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C13H13N3O5S3/c1-7-12(8(2)21-15-7)24(19,20)16-13-14-10-5-4-9(23(3,17)18)6-11(10)22-13/h4-6H,1-3H3,(H,14,16)