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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-ethylphenyl)thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-(4-ethylphenyl)thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-ethylphenyl)thiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-(4-ethylphenyl)thiourea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-(4-ethylphenyl)thiourea Formula: C29H44N2OS MolecularWeight: 468.73746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NCCCCOC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NCCCCOC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C29H44N2OS/c1-8-22-13-16-24(17-14-22)31-27(33)30-19-11-12-20-32-26-18-15-23(28(4,5)9-2)21-25(26)29(6,7)10-3/h13-18,21H,8-12,19-20H2,1-7H3,(H2,30,31,33)