1-[[3-[[5-[(aminocarbonylamino)methyl]-3-tert-butyl-2-oxidanyl-phenyl]methyl]-5-tert-butyl-4-oxidanyl-phenyl]methyl]urea

Systemtic Name: 1-[[3-[[5-[(aminocarbonylamino)methyl]-3-tert-butyl-2-oxidanyl-phenyl]methyl]-5-tert-butyl-4-oxidanyl-phenyl]methyl]urea Openeye Name: [3-tert-butyl-5-[[3-tert-butyl-2-hydroxy-5-(ureidomethyl)phenyl]methyl]-4-hydroxy-phenyl]methylurea CAS Name: [3-tert-butyl-5-[[3-tert-butyl-5-[(carbamoylamino)methyl]-2-hydroxyphenyl]methyl]-4-hydroxyphenyl]methylurea IUPAC Name: [3-tert-butyl-5-[[3-tert-butyl-5-[(carbamoylamino)methyl]-2-hydroxyphenyl]methyl]-4-hydroxyphenyl]methylurea Traditional Name: [3-tert-butyl-5-[3-tert-butyl-2-hydroxy-5-(ureidomethyl)benzyl]-4-hydroxy-benzyl]urea Formula: C25H36N4O4 MolecularWeight: 456.57774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)CC2=C(C(=CC(=C2)CNC(=O)N)C(C)(C)C)O)CNC(=O)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)CC2=C(C(=CC(=C2)CNC(=O)N)C(C)(C)C)O)CNC(=O)N

InChI

InChI=1S/C25H36N4O4/c1-24(2,3)18-9-14(12-28-22(26)32)7-16(20(18)30)11-17-8-15(13-29-23(27)33)10-19(21(17)31)25(4,5)6/h7-10,30-31H,11-13H2,1-6H3,(H3,26,28,32)(H3,27,29,33)