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

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-bromophenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-bromophenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(3-bromophenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(3-bromophenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(3-bromophenyl)methanone Formula: C17H24BrN3O3S MolecularWeight: 430.35976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrN3O3S/c18-16-7-5-6-15(14-16)17(22)19-10-12-21(13-11-19)25(23,24)20-8-3-1-2-4-9-20/h5-7,14H,1-4,8-13H2