4-[(5-ethoxycarbonyl-4-phenyl-1,3-thiazol-2-yl)amino]butanoate

Systemtic Name: 4-[(5-ethoxycarbonyl-4-phenyl-1,3-thiazol-2-yl)amino]butanoate Openeye Name: 4-[(5-ethoxycarbonyl-4-phenyl-thiazol-2-yl)amino]butanoate CAS Name: 4-[(5-ethoxycarbonyl-4-phenyl-2-thiazolyl)amino]butanoate IUPAC Name: 4-[(5-ethoxycarbonyl-4-phenyl-1,3-thiazol-2-yl)amino]butanoate Traditional Name: 4-[(5-carbethoxy-4-phenyl-thiazol-2-yl)amino]butyrate Formula: C16H17N2O4S- MolecularWeight: 333.38218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NCCCC(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NCCCC(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O4S/c1-2-22-15(21)14-13(11-7-4-3-5-8-11)18-16(23-14)17-10-6-9-12(19)20/h3-5,7-8H,2,6,9-10H2,1H3,(H,17,18)(H,19,20)/p-1