1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-(4-methylsulfanylphenoxy)phenyl]urea

Systemtic Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-(4-methylsulfanylphenoxy)phenyl]urea Openeye Name: 1-(5-tert-butylisoxazol-3-yl)-3-[4-(4-methylsulfanylphenoxy)phenyl]urea CAS Name: 1-(5-tert-butyl-3-isoxazolyl)-3-[4-[4-(methylthio)phenoxy]phenyl]urea IUPAC Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-(4-methylsulfanylphenoxy)phenyl]urea Traditional Name: 1-(5-tert-butylisoxazol-3-yl)-3-[4-[4-(methylthio)phenoxy]phenyl]urea Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H23N3O3S/c1-21(2,3)18-13-19(24-27-18)23-20(25)22-14-5-7-15(8-6-14)26-16-9-11-17(28-4)12-10-16/h5-13H,1-4H3,(H2,22,23,24,25)