1-[4-[1-[3,4-bis(hydroxymethyl)phenyl]-3-ethyl-pentan-3-yl]-2-methyl-phenyl]sulfanyl-3-methyl-butan-2-ol

Systemtic Name: 1-[4-[1-[3,4-bis(hydroxymethyl)phenyl]-3-ethyl-pentan-3-yl]-2-methyl-phenyl]sulfanyl-3-methyl-butan-2-ol Openeye Name: 1-[4-[3-[3,4-bis(hydroxymethyl)phenyl]-1,1-diethyl-propyl]-2-methyl-phenyl]sulfanyl-3-methyl-butan-2-ol CAS Name: 1-[[4-[1-[3,4-bis(hydroxymethyl)phenyl]-3-ethylpentan-3-yl]-2-methylphenyl]thio]-3-methyl-2-butanol IUPAC Name: 1-[4-[1-[3,4-bis(hydroxymethyl)phenyl]-3-ethylpentan-3-yl]-2-methylphenyl]sulfanyl-3-methylbutan-2-ol Traditional Name: 1-[[4-[3-(3,4-dimethylolphenyl)-1,1-diethyl-propyl]-2-methyl-phenyl]thio]-3-methyl-butan-2-ol Formula: C27H40O3S MolecularWeight: 444.6697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCC1=CC(=C(C=C1)CO)CO)C2=CC(=C(C=C2)SCC(C(C)C)O)C

Isomeric SMILES

CCC(CC)(CCC1=CC(=C(C=C1)CO)CO)C2=CC(=C(C=C2)SCC(C(C)C)O)C

InChI

InChI=1S/C27H40O3S/c1-6-27(7-2,13-12-21-8-9-22(16-28)23(15-21)17-29)24-10-11-26(20(5)14-24)31-18-25(30)19(3)4/h8-11,14-15,19,25,28-30H,6-7,12-13,16-18H2,1-5H3