1-(1-adamantyl)-3-[1-(phenylsulfonyl)piperidin-4-yl]urea

Systemtic Name: 1-(1-adamantyl)-3-[1-(phenylsulfonyl)piperidin-4-yl]urea Openeye Name: 1-(1-adamantyl)-3-[1-(benzenesulfonyl)-4-piperidyl]urea CAS Name: 1-(1-adamantyl)-3-[1-(benzenesulfonyl)-4-piperidinyl]urea IUPAC Name: 1-(1-adamantyl)-3-[1-(benzenesulfonyl)piperidin-4-yl]urea Traditional Name: 1-(1-adamantyl)-3-(1-besyl-4-piperidyl)urea Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H31N3O3S/c26-21(24-22-13-16-10-17(14-22)12-18(11-16)15-22)23-19-6-8-25(9-7-19)29(27,28)20-4-2-1-3-5-20/h1-5,16-19H,6-15H2,(H2,23,24,26)