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

Systemtic Name: 2-[[(2-ethyl-1,3-thiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[(2-ethylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[[(2-ethyl-4-thiazolyl)methyl-methylamino]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[(2-ethyl-1,3-thiazol-4-yl)methyl-methylcarbamoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[(2-ethylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butyric acid Formula: C13H21N3O3S MolecularWeight: 299.38914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCC1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C13H21N3O3S/c1-5-10-14-9(7-20-10)6-16(4)13(19)15-11(8(2)3)12(17)18/h7-8,11H,5-6H2,1-4H3,(H,15,19)(H,17,18)