1-(2,6-diethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]thiourea Traditional Name: 1-[4-(4-tert-amylphenoxy)phenyl]-3-(2,6-diethylphenyl)thiourea Formula: C28H34N2OS MolecularWeight: 446.64736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C(C)(C)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C(C)(C)CC

InChI

InChI=1S/C28H34N2OS/c1-6-20-10-9-11-21(7-2)26(20)30-27(32)29-23-14-18-25(19-15-23)31-24-16-12-22(13-17-24)28(4,5)8-3/h9-19H,6-8H2,1-5H3,(H2,29,30,32)