1-[2-[3-azanyl-4-methyl-2,6-bis(oxidanyl)-6-pyridin-2-yl-hexoxy]-5-cyclohexyl-phenyl]urea

Systemtic Name: 1-[2-[3-azanyl-4-methyl-2,6-bis(oxidanyl)-6-pyridin-2-yl-hexoxy]-5-cyclohexyl-phenyl]urea Openeye Name: [2-[3-amino-2,6-dihydroxy-4-methyl-6-(2-pyridyl)hexoxy]-5-cyclohexyl-phenyl]urea CAS Name: [2-[3-amino-2,6-dihydroxy-4-methyl-6-(2-pyridinyl)hexoxy]-5-cyclohexylphenyl]urea IUPAC Name: [2-(3-amino-2,6-dihydroxy-4-methyl-6-pyridin-2-ylhexoxy)-5-cyclohexylphenyl]urea Traditional Name: [2-[3-amino-2,6-dihydroxy-4-methyl-6-(2-pyridyl)hexoxy]-5-cyclohexyl-phenyl]urea Formula: C25H36N4O4 MolecularWeight: 456.57774

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=CC=N1)O)C(C(COC2=C(C=C(C=C2)C3CCCCC3)NC(=O)N)O)N

Isomeric SMILES

CC(CC(C1=CC=CC=N1)O)C(C(COC2=C(C=C(C=C2)C3CCCCC3)NC(=O)N)O)N

InChI

InChI=1S/C25H36N4O4/c1-16(13-21(30)19-9-5-6-12-28-19)24(26)22(31)15-33-23-11-10-18(14-20(23)29-25(27)32)17-7-3-2-4-8-17/h5-6,9-12,14,16-17,21-22,24,30-31H,2-4,7-8,13,15,26H2,1H3,(H3,27,29,32)