3-methyl-2-[[1-methyl-5-(methylcarbamoyl)pyrrol-3-yl]sulfonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[1-methyl-5-(methylcarbamoyl)pyrrol-3-yl]sulfonylamino]butanoic acid Openeye Name: 3-methyl-2-[[1-methyl-5-(methylcarbamoyl)pyrrol-3-yl]sulfonylamino]butanoic acid CAS Name: 3-methyl-2-[[1-methyl-5-(methylcarbamoyl)-3-pyrrolyl]sulfonylamino]butanoic acid IUPAC Name: 3-methyl-2-[[1-methyl-5-(methylcarbamoyl)pyrrol-3-yl]sulfonylamino]butanoic acid Traditional Name: 3-methyl-2-[[1-methyl-5-(methylcarbamoyl)pyrrol-3-yl]sulfonylamino]butyric acid Formula: C12H19N3O5S MolecularWeight: 317.36136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CN(C(=C1)C(=O)NC)C

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=CN(C(=C1)C(=O)NC)C

InChI

InChI=1S/C12H19N3O5S/c1-7(2)10(12(17)18)14-21(19,20)8-5-9(11(16)13-3)15(4)6-8/h5-7,10,14H,1-4H3,(H,13,16)(H,17,18)