1-[4-[4-[1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[1-[(5-bromo-2-thienyl)sulfonyl]piperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[1-[(5-bromo-2-thiophenyl)sulfonyl]-4-piperidinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[1-(5-bromothiophen-2-yl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[1-[(5-bromo-2-thienyl)sulfonyl]isonipecotoyl]piperazino]phenyl]ethanone Formula: C22H26BrN3O4S2 MolecularWeight: 540.49354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C22H26BrN3O4S2/c1-16(27)17-2-4-19(5-3-17)24-12-14-25(15-13-24)22(28)18-8-10-26(11-9-18)32(29,30)21-7-6-20(23)31-21/h2-7,18H,8-15H2,1H3