2-[carboxy-[2-(1,3-thiazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(1,3-thiazol-4-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy(2-thiazol-4-ylethyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(4-thiazolyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(1,3-thiazol-4-yl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy(2-thiazol-4-ylethyl)amino]-4-methyl-valeric acid Formula: C12H18N2O4S MolecularWeight: 286.34732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CSC=N1)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CSC=N1)C(=O)O

InChI

InChI=1S/C12H18N2O4S/c1-8(2)5-10(11(15)16)14(12(17)18)4-3-9-6-19-7-13-9/h6-8,10H,3-5H2,1-2H3,(H,15,16)(H,17,18)