3-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]butanoic acid Openeye Name: 3-methyl-2-[(2-phenylthiazol-4-yl)methylamino]butanoic acid CAS Name: 3-methyl-2-[(2-phenyl-4-thiazolyl)methylamino]butanoic acid IUPAC Name: 3-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]butanoic acid Traditional Name: 3-methyl-2-[(2-phenylthiazol-4-yl)methylamino]butyric acid Formula: C15H18N2O2S MolecularWeight: 290.38062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CSC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CSC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2S/c1-10(2)13(15(18)19)16-8-12-9-20-14(17-12)11-6-4-3-5-7-11/h3-7,9-10,13,16H,8H2,1-2H3,(H,18,19)