4-[methyl-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]butanoic acid Openeye Name: 4-[methyl-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]butanoic acid CAS Name: 4-[methyl-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]butanoic acid Traditional Name: 4-[(2-keto-1,3-dihydrobenzimidazol-5-yl)sulfonyl-methyl-amino]butyric acid Formula: C12H15N3O5S MolecularWeight: 313.3296

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)N2

Isomeric SMILES

CN(CCCC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)N2

InChI

InChI=1S/C12H15N3O5S/c1-15(6-2-3-11(16)17)21(19,20)8-4-5-9-10(7-8)14-12(18)13-9/h4-5,7H,2-3,6H2,1H3,(H,16,17)(H2,13,14,18)