(4S)-4-(2-azanyl-1,3-thiazol-4-yl)-4-ethoxycarbonyl-hexanoate

Systemtic Name: (4S)-4-(2-azanyl-1,3-thiazol-4-yl)-4-ethoxycarbonyl-hexanoate Openeye Name: (4S)-4-(2-aminothiazol-4-yl)-4-ethoxycarbonyl-hexanoate CAS Name: (4S)-4-(2-amino-4-thiazolyl)-4-ethoxycarbonylhexanoate IUPAC Name: (4S)-4-(2-amino-1,3-thiazol-4-yl)-4-ethoxycarbonylhexanoate Traditional Name: (4S)-4-(2-aminothiazol-4-yl)-4-carbethoxy-hexanoate Formula: C12H17N2O4S- MolecularWeight: 285.33938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)[O-])(C1=CSC(=N1)N)C(=O)OCC

Isomeric SMILES

CC[C@](CCC(=O)[O-])(C1=CSC(=N1)N)C(=O)OCC

InChI

InChI=1S/C12H18N2O4S/c1-3-12(6-5-9(15)16,10(17)18-4-2)8-7-19-11(13)14-8/h7H,3-6H2,1-2H3,(H2,13,14)(H,15,16)/p-1/t12-/m0/s1