[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(p-tolylsulfonyl)-4-piperidyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [1-(4-methylphenyl)sulfonyl-4-piperidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-(2-pyridyl)piperazino]-(1-tosyl-4-piperidyl)methanone Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H28N4O3S/c1-18-5-7-20(8-6-18)30(28,29)26-12-9-19(10-13-26)22(27)25-16-14-24(15-17-25)21-4-2-3-11-23-21/h2-8,11,19H,9-10,12-17H2,1H3