5-[[2-[bis(2-methylpropyl)amino]ethylamino]methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[2-[bis(2-methylpropyl)amino]ethylamino]methyl]thiophene-2-carboxylic acid Openeye Name: 5-[[2-(diisobutylamino)ethylamino]methyl]thiophene-2-carboxylic acid CAS Name: 5-[[2-[bis(2-methylpropyl)amino]ethylamino]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[2-[bis(2-methylpropyl)amino]ethylamino]methyl]thiophene-2-carboxylic acid Traditional Name: 5-[[2-(diisobutylamino)ethylamino]methyl]-2-thenoic acid Formula: C16H28N2O2S MolecularWeight: 312.47072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCNCC1=CC=C(S1)C(=O)O)CC(C)C

Isomeric SMILES

CC(C)CN(CCNCC1=CC=C(S1)C(=O)O)CC(C)C

InChI

InChI=1S/C16H28N2O2S/c1-12(2)10-18(11-13(3)4)8-7-17-9-14-5-6-15(21-14)16(19)20/h5-6,12-13,17H,7-11H2,1-4H3,(H,19,20)