4-(2,5-dimethylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(2,5-dimethylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(2,5-dimethylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(2,5-dimethylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(2,5-dimethylphenoxy)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(2,5-dimethylphenoxy)-N-(6-mesyl-1,3-benzothiazol-2-yl)butyramide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O4S2/c1-13-6-7-14(2)17(11-13)26-10-4-5-19(23)22-20-21-16-9-8-15(28(3,24)25)12-18(16)27-20/h6-9,11-12H,4-5,10H2,1-3H3,(H,21,22,23)