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pentadecan-3-ylsulfanylbenzene

pentadecan-3-ylsulfanylbenzene

Systemtic Name:pentadecan-3-ylsulfanylbenzene
Openeye Name:1-ethyltridecylsulfanylbenzene
CAS Name:(pentadecan-3-ylthio)benzene
IUPAC Name:pentadecan-3-ylsulfanylbenzene
Traditional Name:(1-ethyltridecylthio)benzene
Formula: C21H36S
MolecularWeight: 320.57554
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC)SC1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCCC(CC)SC1=CC=CC=C1


InChI

InChI=1S/C21H36S/c1-3-5-6-7-8-9-10-11-12-14-17-20(4-2)22-21-18-15-13-16-19-21/h13,15-16,18-20H,3-12,14,17H2,1-2H3


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