3,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 3,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 3,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 3,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 3,3-dimethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3,3-dimethyl-butyramide Formula: C14H18N2O3S2 MolecularWeight: 326.43432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)CC(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C14H18N2O3S2/c1-14(2,3)8-12(17)16-13-15-10-6-5-9(21(4,18)19)7-11(10)20-13/h5-7H,8H2,1-4H3,(H,15,16,17)