4-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonylamino]butanoate

Systemtic Name: 4-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonylamino]butanoate Openeye Name: 4-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)sulfonylamino]butanoate CAS Name: 4-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)sulfonylamino]butanoate IUPAC Name: 4-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonylamino]butanoate Traditional Name: 4-[(2-keto-1,3-dimethyl-benzimidazol-5-yl)sulfonylamino]butyrate Formula: C13H16N3O5S- MolecularWeight: 326.34824

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)[O-])N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)[O-])N(C1=O)C

InChI

InChI=1S/C13H17N3O5S/c1-15-10-6-5-9(8-11(10)16(2)13(15)19)22(20,21)14-7-3-4-12(17)18/h5-6,8,14H,3-4,7H2,1-2H3,(H,17,18)/p-1