1-[2-(1-adamantyl)ethyl]-3-[[3-(methylsulfonylamino)phenyl]methyl]urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-3-[[3-(methylsulfonylamino)phenyl]methyl]urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-3-[[3-(methanesulfonamido)phenyl]methyl]urea CAS Name: 1-[2-(1-adamantyl)ethyl]-3-[[3-(methanesulfonamido)phenyl]methyl]urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-3-[[3-(methanesulfonamido)phenyl]methyl]urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-3-[3-(methanesulfonamido)benzyl]urea Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)NCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)NCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O3S/c1-28(26,27)24-19-4-2-3-15(10-19)14-23-20(25)22-6-5-21-11-16-7-17(12-21)9-18(8-16)13-21/h2-4,10,16-18,24H,5-9,11-14H2,1H3,(H2,22,23,25)