2-butylsulfanyl-1-methyl-4-[3-(phenylmethylsulfanyl)propoxy]benzene

Systemtic Name: 2-butylsulfanyl-1-methyl-4-[3-(phenylmethylsulfanyl)propoxy]benzene Openeye Name: 4-(3-benzylsulfanylpropoxy)-2-butylsulfanyl-1-methyl-benzene CAS Name: 2-(butylthio)-1-methyl-4-[3-(phenylmethylthio)propoxy]benzene IUPAC Name: 4-(3-benzylsulfanylpropoxy)-2-butylsulfanyl-1-methylbenzene Traditional Name: 4-[3-(benzylthio)propoxy]-2-(butylthio)-1-methyl-benzene Formula: C21H28OS2 MolecularWeight: 360.57642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=CC(=C1)OCCCSCC2=CC=CC=C2)C

Isomeric SMILES

CCCCSC1=C(C=CC(=C1)OCCCSCC2=CC=CC=C2)C

InChI

InChI=1S/C21H28OS2/c1-3-4-15-24-21-16-20(12-11-18(21)2)22-13-8-14-23-17-19-9-6-5-7-10-19/h5-7,9-12,16H,3-4,8,13-15,17H2,1-2H3