ethyl 3-bromanyl-4-(1,2,3-thiadiazol-5-ylcarbonylamino)benzoate

Systemtic Name: ethyl 3-bromanyl-4-(1,2,3-thiadiazol-5-ylcarbonylamino)benzoate Openeye Name: ethyl 3-bromo-4-(thiadiazole-5-carbonylamino)benzoate CAS Name: 3-bromo-4-[[oxo(5-thiadiazolyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-(thiadiazole-5-carbonylamino)benzoate Traditional Name: 3-bromo-4-(thiadiazole-5-carbonylamino)benzoic acid ethyl ester Formula: C12H10BrN3O3S MolecularWeight: 356.1951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CN=NS2)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CN=NS2)Br

InChI

InChI=1S/C12H10BrN3O3S/c1-2-19-12(18)7-3-4-9(8(13)5-7)15-11(17)10-6-14-16-20-10/h3-6H,2H2,1H3,(H,15,17)