4-[methyl-[1-methyl-4-(methylsulfamoyl)pyrrol-2-yl]carbonyl-amino]butanoic acid

Systemtic Name: 4-[methyl-[1-methyl-4-(methylsulfamoyl)pyrrol-2-yl]carbonyl-amino]butanoic acid Openeye Name: 4-[methyl-[1-methyl-4-(methylsulfamoyl)pyrrole-2-carbonyl]amino]butanoic acid CAS Name: 4-[methyl-[[1-methyl-4-(methylsulfamoyl)-2-pyrrolyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[methyl-[1-methyl-4-(methylsulfamoyl)pyrrole-2-carbonyl]amino]butanoic acid Traditional Name: 4-[methyl-[1-methyl-4-(methylsulfamoyl)pyrrole-2-carbonyl]amino]butyric acid Formula: C12H19N3O5S MolecularWeight: 317.36136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CN(C(=C1)C(=O)N(C)CCCC(=O)O)C

Isomeric SMILES

CNS(=O)(=O)C1=CN(C(=C1)C(=O)N(C)CCCC(=O)O)C

InChI

InChI=1S/C12H19N3O5S/c1-13-21(19,20)9-7-10(15(3)8-9)12(18)14(2)6-4-5-11(16)17/h7-8,13H,4-6H2,1-3H3,(H,16,17)