1-[4-[4-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[1-(1-methylimidazol-4-yl)sulfonylisonipecotoyl]piperazino]phenyl]ethanone Formula: C22H29N5O4S MolecularWeight: 459.56176

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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=CN(C=N4)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C=N4)C

InChI

InChI=1S/C22H29N5O4S/c1-17(28)18-3-5-20(6-4-18)25-11-13-26(14-12-25)22(29)19-7-9-27(10-8-19)32(30,31)21-15-24(2)16-23-21/h3-6,15-16,19H,7-14H2,1-2H3