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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-butyl-thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-butyl-thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-butylthiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-butylthiourea Traditional Name: 1-butyl-3-[4-(2,4-ditert-amylphenoxy)butyl]thiourea Formula: C25H44N2OS MolecularWeight: 420.69466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCCCCOC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCCNC(=S)NCCCCOC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C25H44N2OS/c1-8-11-16-26-23(29)27-17-12-13-18-28-22-15-14-20(24(4,5)9-2)19-21(22)25(6,7)10-3/h14-15,19H,8-13,16-18H2,1-7H3,(H2,26,27,29)