ethyl 4-[2-[[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-(3-bromophenyl)oxazol-2-yl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[5-(3-bromophenyl)-2-oxazolyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[5-(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[5-(3-bromophenyl)oxazol-2-yl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C20H17BrN2O4S MolecularWeight: 461.32898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C(O2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=C(O2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H17BrN2O4S/c1-2-26-19(25)13-6-8-16(9-7-13)23-18(24)12-28-20-22-11-17(27-20)14-4-3-5-15(21)10-14/h3-11H,2,12H2,1H3,(H,23,24)