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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-(tetrahydrofurfuryl)thiourea Formula: C26H44N2O2S MolecularWeight: 448.70476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NCC2CCCO2)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NCC2CCCO2)C(C)(C)CC

InChI

InChI=1S/C26H44N2O2S/c1-7-25(3,4)20-13-14-23(22(18-20)26(5,6)8-2)30-16-10-9-15-27-24(31)28-19-21-12-11-17-29-21/h13-14,18,21H,7-12,15-17,19H2,1-6H3,(H2,27,28,31)