[4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-(o-tolylmethyl)piperazin-1-yl]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone CAS Name: [4-[(2-methylphenyl)methyl]-1-piperazinyl]-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-(2-methylbenzyl)piperazino]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H30N4O3S/c1-19-5-2-3-6-21(19)18-25-13-15-26(16-14-25)23(28)20-8-11-27(12-9-20)31(29,30)22-7-4-10-24-17-22/h2-7,10,17,20H,8-9,11-16,18H2,1H3