1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-ethoxyphenyl)thiourea

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-ethoxyphenyl)thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(2-ethoxyphenyl)thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-ethoxyphenyl)thiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-ethoxyphenyl)thiourea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-o-phenetyl-thiourea Formula: C29H44N2O2S MolecularWeight: 484.73686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=CC=CC=C2OCC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=CC=CC=C2OCC)C(C)(C)CC

InChI

InChI=1S/C29H44N2O2S/c1-8-28(4,5)22-17-18-25(23(21-22)29(6,7)9-2)33-20-14-13-19-30-27(34)31-24-15-11-12-16-26(24)32-10-3/h11-12,15-18,21H,8-10,13-14,19-20H2,1-7H3,(H2,30,31,34)