[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromanyl-2-oxidanyl-phenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromanyl-2-oxidanyl-phenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromo-2-hydroxy-phenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(5-bromo-2-hydroxyphenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-bromo-2-hydroxyphenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(5-bromo-2-hydroxy-phenyl)methanone Formula: C17H24BrN3O4S MolecularWeight: 446.35916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrN3O4S/c18-14-5-6-16(22)15(13-14)17(23)19-9-11-21(12-10-19)26(24,25)20-7-3-1-2-4-8-20/h5-6,13,22H,1-4,7-12H2