1-(1-adamantyl)-3-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methyl]urea Openeye Name: 1-(1-adamantyl)-3-[[1-(p-tolylsulfonyl)-4-piperidyl]methyl]urea CAS Name: 1-(1-adamantyl)-3-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]methyl]urea IUPAC Name: 1-(1-adamantyl)-3-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methyl]urea Traditional Name: 1-(1-adamantyl)-3-[(1-tosyl-4-piperidyl)methyl]urea Formula: C24H35N3O3S MolecularWeight: 445.618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H35N3O3S/c1-17-2-4-22(5-3-17)31(29,30)27-8-6-18(7-9-27)16-25-23(28)26-24-13-19-10-20(14-24)12-21(11-19)15-24/h2-5,18-21H,6-16H2,1H3,(H2,25,26,28)