4-[(3-methyl-4-phenyl-butyl)sulfanylmethyl]-2-propan-2-yl-phenol

Systemtic Name: 4-[(3-methyl-4-phenyl-butyl)sulfanylmethyl]-2-propan-2-yl-phenol Openeye Name: 2-isopropyl-4-[(3-methyl-4-phenyl-butyl)sulfanylmethyl]phenol CAS Name: 4-[[(3-methyl-4-phenylbutyl)thio]methyl]-2-propan-2-ylphenol IUPAC Name: 4-[(3-methyl-4-phenylbutyl)sulfanylmethyl]-2-propan-2-ylphenol Traditional Name: 2-isopropyl-4-[[(3-methyl-4-phenyl-butyl)thio]methyl]phenol Formula: C21H28OS MolecularWeight: 328.51142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)CSCCC(C)CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)CSCCC(C)CC2=CC=CC=C2)O

InChI

InChI=1S/C21H28OS/c1-16(2)20-14-19(9-10-21(20)22)15-23-12-11-17(3)13-18-7-5-4-6-8-18/h4-10,14,16-17,22H,11-13,15H2,1-3H3