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

Systemtic Name: ethyl 2-[2-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[4-(2-bromo-4-tert-butylphenoxy)-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(2-bromo-4-tert-butylphenoxy)butanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H27BrN2O4S MolecularWeight: 483.41908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C21H27BrN2O4S/c1-5-27-19(26)12-15-13-29-20(23-15)24-18(25)7-6-10-28-17-9-8-14(11-16(17)22)21(2,3)4/h8-9,11,13H,5-7,10,12H2,1-4H3,(H,23,24,25)