3,3-dimethyl-2-[2-[(5-methylthiophen-2-yl)carbonylamino]ethanoylamino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[2-[(5-methylthiophen-2-yl)carbonylamino]ethanoylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]butanoic acid CAS Name: 3,3-dimethyl-2-[[2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]butanoic acid Traditional Name: 3,3-dimethyl-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]butyric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC(=O)NC(C(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC(=O)NC(C(=O)O)C(C)(C)C

InChI

InChI=1S/C14H20N2O4S/c1-8-5-6-9(21-8)12(18)15-7-10(17)16-11(13(19)20)14(2,3)4/h5-6,11H,7H2,1-4H3,(H,15,18)(H,16,17)(H,19,20)