1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-oxidanylidene-butyl]-2-oxidanyl-phenyl]urea

Systemtic Name: 1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-oxidanylidene-butyl]-2-oxidanyl-phenyl]urea Openeye Name: 1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-oxo-butyl]-2-hydroxy-phenyl]urea CAS Name: 1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-oxobutyl]-2-hydroxyphenyl]urea IUPAC Name: 1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-oxobutyl]-2-hydroxyphenyl]urea Traditional Name: 1-(4-cyanophenyl)-3-[4-[3-(2,4-dimethylphenoxy)-2-keto-butyl]-2-hydroxy-phenyl]urea Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)CC2=CC(=C(C=C2)NC(=O)NC3=CC=C(C=C3)C#N)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C(=O)CC2=CC(=C(C=C2)NC(=O)NC3=CC=C(C=C3)C#N)O)C

InChI

InChI=1S/C26H25N3O4/c1-16-4-11-25(17(2)12-16)33-18(3)23(30)13-20-7-10-22(24(31)14-20)29-26(32)28-21-8-5-19(15-27)6-9-21/h4-12,14,18,31H,13H2,1-3H3,(H2,28,29,32)