3-[4-[3-[[3,4-bis(hydroxymethyl)phenyl]methylsulfanyl]phenyl]-3-methyl-phenyl]pentan-3-ol

Systemtic Name: 3-[4-[3-[[3,4-bis(hydroxymethyl)phenyl]methylsulfanyl]phenyl]-3-methyl-phenyl]pentan-3-ol Openeye Name: 3-[4-[3-[[3,4-bis(hydroxymethyl)phenyl]methylsulfanyl]phenyl]-3-methyl-phenyl]pentan-3-ol CAS Name: 3-[4-[3-[[3,4-bis(hydroxymethyl)phenyl]methylthio]phenyl]-3-methylphenyl]-3-pentanol IUPAC Name: 3-[4-[3-[[3,4-bis(hydroxymethyl)phenyl]methylsulfanyl]phenyl]-3-methylphenyl]pentan-3-ol Traditional Name: 3-[4-[3-[(3,4-dimethylolbenzyl)thio]phenyl]-3-methyl-phenyl]pentan-3-ol Formula: C27H32O3S MolecularWeight: 436.60618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C2=CC(=CC=C2)SCC3=CC(=C(C=C3)CO)CO)C)O

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C2=CC(=CC=C2)SCC3=CC(=C(C=C3)CO)CO)C)O

InChI

InChI=1S/C27H32O3S/c1-4-27(30,5-2)24-11-12-26(19(3)13-24)21-7-6-8-25(15-21)31-18-20-9-10-22(16-28)23(14-20)17-29/h6-15,28-30H,4-5,16-18H2,1-3H3