ethyl 2-[2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(2-bromo-4,5-dimethoxyphenyl)propanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C18H21BrN2O5S MolecularWeight: 457.33874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C18H21BrN2O5S/c1-4-26-17(23)8-12-10-27-18(20-12)21-16(22)6-5-11-7-14(24-2)15(25-3)9-13(11)19/h7,9-10H,4-6,8H2,1-3H3,(H,20,21,22)