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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(4-butylphenyl)thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-butylphenyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-[4-(2,4-ditert-amylphenoxy)butyl]thiourea Formula: C31H48N2OS MolecularWeight: 496.79062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCCCCOC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCCCCOC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C31H48N2OS/c1-8-11-14-24-15-18-26(19-16-24)33-29(35)32-21-12-13-22-34-28-20-17-25(30(4,5)9-2)23-27(28)31(6,7)10-3/h15-20,23H,8-14,21-22H2,1-7H3,(H2,32,33,35)