1-(2,3-dimethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea Traditional Name: 1-[4-(4-tert-amylphenoxy)phenyl]-3-(2,3-dimethylphenyl)thiourea Formula: C26H30N2OS MolecularWeight: 418.5942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C26H30N2OS/c1-6-26(4,5)20-10-14-22(15-11-20)29-23-16-12-21(13-17-23)27-25(30)28-24-9-7-8-18(2)19(24)3/h7-17H,6H2,1-5H3,(H2,27,28,30)