N-(3,5-dimethoxyphenyl)-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide CAS Name: N-(3,5-dimethoxyphenyl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)butyramide Formula: C21H25N3O7S2 MolecularWeight: 495.5691

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)NC3=CC(=CC(=C3)OC)OC)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)NC3=CC(=CC(=C3)OC)OC)OC1=O

InChI

InChI=1S/C21H25N3O7S2/c1-24-18-6-5-16(12-19(18)31-21(24)26)33(27,28)23-17(7-8-32-4)20(25)22-13-9-14(29-2)11-15(10-13)30-3/h5-6,9-12,17,23H,7-8H2,1-4H3,(H,22,25)