N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-2-(tosylamino)butyramide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S2/c1-12(2)18(23-29(25,26)15-8-5-13(3)6-9-15)19(24)22-20-21-16-10-7-14(27-4)11-17(16)28-20/h5-12,18,23H,1-4H3,(H,21,22,24)