(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C14H13BrClN3O5S2 MolecularWeight: 482.75712

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=C(SN=N3)Cl)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=C(SN=N3)Cl)Br

InChI

InChI=1S/C14H13BrClN3O5S2/c15-10-2-1-9(14(20)24-8-11-13(16)25-18-17-11)7-12(10)26(21,22)19-3-5-23-6-4-19/h1-2,7H,3-6,8H2