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

Systemtic Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-phenyl-thiourea Openeye Name: 1-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-3-phenyl-thiourea CAS Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-phenylthiourea IUPAC Name: 1-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-3-phenylthiourea Traditional Name: 1-[4-(2,4-ditert-amylphenoxy)butyl]-3-phenyl-thiourea Formula: C27H40N2OS MolecularWeight: 440.6843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=CC=CC=C2)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=CC=CC=C2)C(C)(C)CC

InChI

InChI=1S/C27H40N2OS/c1-7-26(3,4)21-16-17-24(23(20-21)27(5,6)8-2)30-19-13-12-18-28-25(31)29-22-14-10-9-11-15-22/h9-11,14-17,20H,7-8,12-13,18-19H2,1-6H3,(H2,28,29,31)