1-chloranyl-2-pentylsulfanyl-4-[3-(phenylmethylsulfanyl)propoxy]benzene

Systemtic Name: 1-chloranyl-2-pentylsulfanyl-4-[3-(phenylmethylsulfanyl)propoxy]benzene Openeye Name: 4-(3-benzylsulfanylpropoxy)-1-chloro-2-pentylsulfanyl-benzene CAS Name: 1-chloro-2-(pentylthio)-4-[3-(phenylmethylthio)propoxy]benzene IUPAC Name: 4-(3-benzylsulfanylpropoxy)-1-chloro-2-pentylsulfanylbenzene Traditional Name: 2-(amylthio)-4-[3-(benzylthio)propoxy]-1-chloro-benzene Formula: C21H27ClOS2 MolecularWeight: 395.02148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=CC(=C1)OCCCSCC2=CC=CC=C2)Cl

Isomeric SMILES

CCCCCSC1=C(C=CC(=C1)OCCCSCC2=CC=CC=C2)Cl

InChI

InChI=1S/C21H27ClOS2/c1-2-3-7-15-25-21-16-19(11-12-20(21)22)23-13-8-14-24-17-18-9-5-4-6-10-18/h4-6,9-12,16H,2-3,7-8,13-15,17H2,1H3