1-(5-azidosulfonylpentyl)-3-[[3,5-bis(3-methylbutyl)-4-oxidanyl-phenyl]methyl]urea

Systemtic Name: 1-(5-azidosulfonylpentyl)-3-[[3,5-bis(3-methylbutyl)-4-oxidanyl-phenyl]methyl]urea Openeye Name: 1-(5-azidosulfonylpentyl)-3-[(4-hydroxy-3,5-diisopentyl-phenyl)methyl]urea CAS Name: 1-(5-azidosulfonylpentyl)-3-[[4-hydroxy-3,5-bis(3-methylbutyl)phenyl]methyl]urea IUPAC Name: 1-(5-azidosulfonylpentyl)-3-[[4-hydroxy-3,5-bis(3-methylbutyl)phenyl]methyl]urea Traditional Name: 1-(5-azidosulfonylpentyl)-3-(4-hydroxy-3,5-diisoamyl-benzyl)urea Formula: C23H39N5O4S MolecularWeight: 481.65186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC(=CC(=C1O)CCC(C)C)CNC(=O)NCCCCCS(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CC(C)CCC1=CC(=CC(=C1O)CCC(C)C)CNC(=O)NCCCCCS(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C23H39N5O4S/c1-17(2)8-10-20-14-19(15-21(22(20)29)11-9-18(3)4)16-26-23(30)25-12-6-5-7-13-33(31,32)28-27-24/h14-15,17-18,29H,5-13,16H2,1-4H3,(H2,25,26,30)