3-methyl-2-[2-[(5-methylthiophen-2-yl)carbonylamino]ethanoylamino]pentanoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C1=CC=C(S1)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C1=CC=C(S1)C

InChI

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