1-[2-(2-tert-butylphenoxy)pyridin-3-yl]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[2-(2-tert-butylphenoxy)pyridin-3-yl]-3-(4-methylphenyl)thiourea Openeye Name: 1-[2-(2-tert-butylphenoxy)-3-pyridyl]-3-(p-tolyl)thiourea CAS Name: 1-[2-(2-tert-butylphenoxy)-3-pyridinyl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[2-(2-tert-butylphenoxy)pyridin-3-yl]-3-(4-methylphenyl)thiourea Traditional Name: 1-[2-(2-tert-butylphenoxy)-3-pyridyl]-3-(p-tolyl)thiourea Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)OC3=CC=CC=C3C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)OC3=CC=CC=C3C(C)(C)C

InChI

InChI=1S/C23H25N3OS/c1-16-11-13-17(14-12-16)25-22(28)26-19-9-7-15-24-21(19)27-20-10-6-5-8-18(20)23(2,3)4/h5-15H,1-4H3,(H2,25,26,28)