[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromo-3-pyridyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(5-bromo-3-pyridinyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromopyridin-3-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(5-bromo-3-pyridyl)methanone Formula: C16H23BrN4O3S MolecularWeight: 431.34782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H23BrN4O3S/c17-15-11-14(12-18-13-15)16(22)19-7-9-21(10-8-19)25(23,24)20-5-3-1-2-4-6-20/h11-13H,1-10H2