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

Systemtic Name: ethyl 2-[2-[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C18H21BrN2O4S MolecularWeight: 441.33934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)COC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)COC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C18H21BrN2O4S/c1-4-24-17(23)8-13-10-26-18(20-13)21-16(22)9-25-15-6-5-12(11(2)3)7-14(15)19/h5-7,10-11H,4,8-9H2,1-3H3,(H,20,21,22)