(E)-2-(2-azanyl-1,3-thiazol-4-yl)pent-2-enoic acid

Systemtic Name: (E)-2-(2-azanyl-1,3-thiazol-4-yl)pent-2-enoic acid Openeye Name: (E)-2-(2-aminothiazol-4-yl)pent-2-enoic acid CAS Name: (E)-2-(2-amino-4-thiazolyl)-2-pentenoic acid IUPAC Name: (E)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoic acid Traditional Name: (E)-2-(2-aminothiazol-4-yl)pent-2-enoic acid Formula: C8H10N2O2S MolecularWeight: 198.2422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CSC(=N1)N)C(=O)O

Isomeric SMILES

CC/C=C(\C1=CSC(=N1)N)/C(=O)O

InChI

InChI=1S/C8H10N2O2S/c1-2-3-5(7(11)12)6-4-13-8(9)10-6/h3-4H,2H2,1H3,(H2,9,10)(H,11,12)/b5-3+