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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(2-furylmethyl)thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-(2-furfuryl)thiourea Formula: C26H40N2O2S MolecularWeight: 444.673

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NCC2=CC=CO2)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NCC2=CC=CO2)C(C)(C)CC

InChI

InChI=1S/C26H40N2O2S/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/h11-14,17-18H,7-10,15-16,19H2,1-6H3,(H2,27,28,31)