1-[2-(2-tert-butylphenoxy)-5-cyano-pyridin-3-yl]-3-(4-tert-butylphenyl)urea

Systemtic Name: 1-[2-(2-tert-butylphenoxy)-5-cyano-pyridin-3-yl]-3-(4-tert-butylphenyl)urea Openeye Name: 1-[2-(2-tert-butylphenoxy)-5-cyano-3-pyridyl]-3-(4-tert-butylphenyl)urea CAS Name: 1-[2-(2-tert-butylphenoxy)-5-cyano-3-pyridinyl]-3-(4-tert-butylphenyl)urea IUPAC Name: 1-[2-(2-tert-butylphenoxy)-5-cyanopyridin-3-yl]-3-(4-tert-butylphenyl)urea Traditional Name: 1-[2-(2-tert-butylphenoxy)-5-cyano-3-pyridyl]-3-(4-tert-butylphenyl)urea Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=C(N=CC(=C2)C#N)OC3=CC=CC=C3C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=C(N=CC(=C2)C#N)OC3=CC=CC=C3C(C)(C)C

InChI

InChI=1S/C27H30N4O2/c1-26(2,3)19-11-13-20(14-12-19)30-25(32)31-22-15-18(16-28)17-29-24(22)33-23-10-8-7-9-21(23)27(4,5)6/h7-15,17H,1-6H3,(H2,30,31,32)