1,4-dibutoxy-2-methyl-5-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-benzene

Systemtic Name: 1,4-dibutoxy-2-methyl-5-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanyl-benzene Openeye Name: 1,4-dibutoxy-2-methyl-5-[4-(1,1,3,3-tetramethylbutyl)phenyl]sulfanyl-benzene CAS Name: 1,4-dibutoxy-2-methyl-5-[[4-(2,4,4-trimethylpentan-2-yl)phenyl]thio]benzene IUPAC Name: 1,4-dibutoxy-2-methyl-5-[4-(2,4,4-trimethylpentan-2-yl)phenyl]sulfanylbenzene Traditional Name: 1,4-dibutoxy-2-methyl-5-[[4-(1,1,3,3-tetramethylbutyl)phenyl]thio]benzene Formula: C29H44O2S MolecularWeight: 456.72346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1C)OCCCC)SC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCOC1=CC(=C(C=C1C)OCCCC)SC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C29H44O2S/c1-9-11-17-30-25-20-27(26(19-22(25)3)31-18-12-10-2)32-24-15-13-23(14-16-24)29(7,8)21-28(4,5)6/h13-16,19-20H,9-12,17-18,21H2,1-8H3