4-[(4-ethyl-5-methyl-thiophen-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-[(4-ethyl-5-methyl-thiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 4-[(4-ethyl-5-methyl-thiophene-2-carbonyl)amino]butanoic acid CAS Name: 4-[[(4-ethyl-5-methyl-2-thiophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(4-ethyl-5-methylthiophene-2-carbonyl)amino]butanoic acid Traditional Name: 4-[(4-ethyl-5-methyl-thiophene-2-carbonyl)amino]butyric acid Formula: C12H17NO3S MolecularWeight: 255.33328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)NCCCC(=O)O)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)NCCCC(=O)O)C

InChI

InChI=1S/C12H17NO3S/c1-3-9-7-10(17-8(9)2)12(16)13-6-4-5-11(14)15/h7H,3-6H2,1-2H3,(H,13,16)(H,14,15)