1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-3,4-bis(oxidanyl)-1,6-diphenyl-hexan-2-yl]urea

Systemtic Name: 1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-3,4-bis(oxidanyl)-1,6-diphenyl-hexan-2-yl]urea Openeye Name: 1-[1-benzyl-4-(tert-butylcarbamoylamino)-2,3-dihydroxy-5-phenyl-pentyl]-3-tert-butyl-urea CAS Name: 1-tert-butyl-3-[5-[[(tert-butylamino)-oxomethyl]amino]-3,4-dihydroxy-1,6-diphenylhexan-2-yl]urea IUPAC Name: 1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-3,4-dihydroxy-1,6-diphenylhexan-2-yl]urea Traditional Name: 1-[1-benzyl-4-(tert-butylcarbamoylamino)-2,3-dihydroxy-5-phenyl-pentyl]-3-tert-butyl-urea Formula: C28H42N4O4 MolecularWeight: 498.65748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)NC(=O)NC(C)(C)C)O)O

Isomeric SMILES

CC(C)(C)NC(=O)NC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)NC(=O)NC(C)(C)C)O)O

InChI

InChI=1S/C28H42N4O4/c1-27(2,3)31-25(35)29-21(17-19-13-9-7-10-14-19)23(33)24(34)22(18-20-15-11-8-12-16-20)30-26(36)32-28(4,5)6/h7-16,21-24,33-34H,17-18H2,1-6H3,(H2,29,31,35)(H2,30,32,36)