ethyl 2-[[(2-chloranyl-2-phenyl-ethanoyl)-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(2-chloranyl-2-phenyl-ethanoyl)-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2-chloro-2-phenyl-acetyl)-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(2-chloro-1-oxo-2-phenylethyl)-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2-chloro-2-phenylacetyl)-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2-chloro-2-phenyl-acetyl)-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H23ClN2O4S MolecularWeight: 410.91492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)C(C2=CC=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)C(C2=CC=CC=C2)Cl

InChI

InChI=1S/C19H23ClN2O4S/c1-3-26-19(24)15-13-27-16(21-15)12-22(10-7-11-25-2)18(23)17(20)14-8-5-4-6-9-14/h4-6,8-9,13,17H,3,7,10-12H2,1-2H3