ethyl 2-[2-[4-(2-bromanyl-4-ethyl-phenoxy)butanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[4-(2-bromanyl-4-ethyl-phenoxy)butanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[4-(2-bromo-4-ethyl-phenoxy)butanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[4-(2-bromo-4-ethylphenoxy)-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(2-bromo-4-ethylphenoxy)butanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[4-(2-bromo-4-ethyl-phenoxy)butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C19H23BrN2O4S MolecularWeight: 455.36592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=NC(=CS2)CC(=O)OCC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=NC(=CS2)CC(=O)OCC)Br

InChI

InChI=1S/C19H23BrN2O4S/c1-3-13-7-8-16(15(20)10-13)26-9-5-6-17(23)22-19-21-14(12-27-19)11-18(24)25-4-2/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,21,22,23)