[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(5-bromo-3-pyridyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-(5-bromo-3-pyridinyl)methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(5-bromopyridin-3-yl)methanone Traditional Name: (5-bromo-3-pyridyl)-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C16H14BrN5O3S2 MolecularWeight: 468.34806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CN=C2)Br)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CN=C2)Br)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C16H14BrN5O3S2/c17-12-8-11(9-18-10-12)16(23)21-4-6-22(7-5-21)27(24,25)14-3-1-2-13-15(14)20-26-19-13/h1-3,8-10H,4-7H2