1-[2-[3-azanyl-4-(6-methylpyridin-3-yl)-2,4-bis(oxidanyl)heptoxy]-5-cyclohexyl-phenyl]urea

Systemtic Name: 1-[2-[3-azanyl-4-(6-methylpyridin-3-yl)-2,4-bis(oxidanyl)heptoxy]-5-cyclohexyl-phenyl]urea Openeye Name: [2-[3-amino-2,4-dihydroxy-4-(6-methyl-3-pyridyl)heptoxy]-5-cyclohexyl-phenyl]urea CAS Name: [2-[3-amino-2,4-dihydroxy-4-(6-methyl-3-pyridinyl)heptoxy]-5-cyclohexylphenyl]urea IUPAC Name: [2-[3-amino-2,4-dihydroxy-4-(6-methylpyridin-3-yl)heptoxy]-5-cyclohexylphenyl]urea Traditional Name: [2-[3-amino-2,4-dihydroxy-4-(6-methyl-3-pyridyl)heptoxy]-5-cyclohexyl-phenyl]urea Formula: C26H38N4O4 MolecularWeight: 470.60432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CN=C(C=C1)C)(C(C(COC2=C(C=C(C=C2)C3CCCCC3)NC(=O)N)O)N)O

Isomeric SMILES

CCCC(C1=CN=C(C=C1)C)(C(C(COC2=C(C=C(C=C2)C3CCCCC3)NC(=O)N)O)N)O

InChI

InChI=1S/C26H38N4O4/c1-3-13-26(33,20-11-9-17(2)29-15-20)24(27)22(31)16-34-23-12-10-19(14-21(23)30-25(28)32)18-7-5-4-6-8-18/h9-12,14-15,18,22,24,31,33H,3-8,13,16,27H2,1-2H3,(H3,28,30,32)