1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonylpiperidin-2-yl]methyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonylpiperidin-2-yl]methyl]urea Openeye Name: 1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonyl-2-piperidyl]methyl]urea CAS Name: 1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonyl-2-piperidinyl]methyl]urea IUPAC Name: 1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonylpiperidin-2-yl]methyl]urea Traditional Name: 1-(1-adamantyl)-3-[[1-(2,4-dimethoxyphenyl)sulfonyl-2-piperidyl]methyl]urea Formula: C25H37N3O5S MolecularWeight: 491.64338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)N2CCCCC2CNC(=O)NC34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)N2CCCCC2CNC(=O)NC34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C25H37N3O5S/c1-32-21-6-7-23(22(12-21)33-2)34(30,31)28-8-4-3-5-20(28)16-26-24(29)27-25-13-17-9-18(14-25)11-19(10-17)15-25/h6-7,12,17-20H,3-5,8-11,13-16H2,1-2H3,(H2,26,27,29)