1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)butyl]urea

Systemtic Name: 1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)butyl]urea Openeye Name: 1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)butyl]urea CAS Name: 1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-hydroxyphenyl)butyl]urea IUPAC Name: 1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-hydroxyphenyl)butyl]urea Traditional Name: 1-(4-azidosulfonylphenyl)-1-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)butyl]urea Formula: C25H35N5O4S MolecularWeight: 501.6415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCN(C2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-])C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCN(C2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-])C(=O)N

InChI

InChI=1S/C25H35N5O4S/c1-24(2,3)20-15-17(16-21(22(20)31)25(4,5)6)9-7-8-14-30(23(26)32)18-10-12-19(13-11-18)35(33,34)29-28-27/h10-13,15-16,31H,7-9,14H2,1-6H3,(H2,26,32)