1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(3-oxidanylpyridin-2-yl)urea

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(3-oxidanylpyridin-2-yl)urea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(3-hydroxy-2-pyridyl)urea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(3-hydroxy-2-pyridinyl)urea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(3-hydroxypyridin-2-yl)urea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-(3-hydroxy-2-pyridyl)urea Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)NC2=C(C=CC=N2)O)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)NC2=C(C=CC=N2)O)C(C)(C)CC

InChI

InChI=1S/C26H39N3O3/c1-7-25(3,4)19-13-14-22(20(18-19)26(5,6)8-2)32-17-10-9-15-28-24(31)29-23-21(30)12-11-16-27-23/h11-14,16,18,30H,7-10,15,17H2,1-6H3,(H2,27,28,29,31)