1-[4-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[[4-[4-(m-tolylmethyl)piperazine-1-carbonyl]-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[4-[[4-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-[4-(3-methylbenzyl)piperazine-1-carbonyl]piperidino]sulfonylphenyl]ethanone Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C26H33N3O4S/c1-20-4-3-5-22(18-20)19-27-14-16-28(17-15-27)26(31)24-10-12-29(13-11-24)34(32,33)25-8-6-23(7-9-25)21(2)30/h3-9,18,24H,10-17,19H2,1-2H3