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

Systemtic Name: 4-[[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]sulfonyl-methyl-amino]butanoic acid Openeye Name: 4-[(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)sulfonyl-methyl-amino]butanoic acid CAS Name: 4-[(1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)sulfonyl-methylamino]butanoic acid IUPAC Name: 4-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)sulfonyl-methylamino]butanoic acid Traditional Name: 4-[(2,4-diketo-1,3-dimethyl-pyrimidin-5-yl)sulfonyl-methyl-amino]butyric acid Formula: C11H17N3O6S MolecularWeight: 319.33418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N(C)CCCC(=O)O

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C11H17N3O6S/c1-12-7-8(10(17)14(3)11(12)18)21(19,20)13(2)6-4-5-9(15)16/h7H,4-6H2,1-3H3,(H,15,16)