2-[(4-bromanyl-1,2-thiazol-5-yl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(4-bromanyl-1,2-thiazol-5-yl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[(4-bromoisothiazol-5-yl)amino]-4-methyl-pentanoic acid CAS Name: 2-[(4-bromo-5-isothiazolyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[(4-bromo-1,2-thiazol-5-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(4-bromoisothiazol-5-yl)amino]-4-methyl-valeric acid Formula: C9H13BrN2O2S MolecularWeight: 293.18072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=C(C=NS1)Br

Isomeric SMILES

CC(C)CC(C(=O)O)NC1=C(C=NS1)Br

InChI

InChI=1S/C9H13BrN2O2S/c1-5(2)3-7(9(13)14)12-8-6(10)4-11-15-8/h4-5,7,12H,3H2,1-2H3,(H,13,14)