(4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridin-3-yl]methanone

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(phenylsulfonyl)piperidin-4-yl]pyridin-3-yl]methanone Openeye Name: [2-[1-(benzenesulfonyl)-4-piperidyl]-6-methyl-3-pyridyl]-(4-cyclohexylpiperazin-1-yl)methanone CAS Name: [2-[1-(benzenesulfonyl)-4-piperidinyl]-6-methyl-3-pyridinyl]-(4-cyclohexyl-1-piperazinyl)methanone IUPAC Name: [2-[1-(benzenesulfonyl)piperidin-4-yl]-6-methylpyridin-3-yl]-(4-cyclohexylpiperazin-1-yl)methanone Traditional Name: [2-(1-besyl-4-piperidyl)-6-methyl-3-pyridyl]-(4-cyclohexylpiperazino)methanone Formula: C28H38N4O3S MolecularWeight: 510.69132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H38N4O3S/c1-22-12-13-26(28(33)31-20-18-30(19-21-31)24-8-4-2-5-9-24)27(29-22)23-14-16-32(17-15-23)36(34,35)25-10-6-3-7-11-25/h3,6-7,10-13,23-24H,2,4-5,8-9,14-21H2,1H3