1-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]azepan-2-one

Systemtic Name: 1-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]azepan-2-one Openeye Name: 1-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]azepan-2-one CAS Name: 1-[2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-azepanone IUPAC Name: 1-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]azepan-2-one Traditional Name: 1-[2-(4-brosylpiperazino)-2-keto-ethyl]azepan-2-one Formula: C18H24BrN3O4S MolecularWeight: 458.36986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H24BrN3O4S/c19-15-5-7-16(8-6-15)27(25,26)22-12-10-20(11-13-22)18(24)14-21-9-3-1-2-4-17(21)23/h5-8H,1-4,9-14H2