tert-butyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-bromo-6-chloropyridin-3-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C14H19BrClN3O4S MolecularWeight: 440.74036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(N=C2)Cl)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(N=C2)Cl)Br

InChI

InChI=1S/C14H19BrClN3O4S/c1-14(2,3)23-13(20)18-4-6-19(7-5-18)24(21,22)10-8-11(15)12(16)17-9-10/h8-9H,4-7H2,1-3H3