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1,3,5-triethyl-2-isothiocyanato-benzene

1,3,5-triethyl-2-isothiocyanato-benzene

Systemtic Name:1,3,5-triethyl-2-isothiocyanato-benzene
Openeye Name:1,3,5-triethyl-2-isothiocyanato-benzene
CAS Name:1,3,5-triethyl-2-isothiocyanatobenzene
IUPAC Name:1,3,5-triethyl-2-isothiocyanatobenzene
Traditional Name:1,3,5-triethyl-2-isothiocyanato-benzene
Formula: C13H17NS
MolecularWeight: 219.34578
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)CC)N=C=S)CC


Isomeric SMILES

CCC1=CC(=C(C(=C1)CC)N=C=S)CC


InChI

InChI=1S/C13H17NS/c1-4-10-7-11(5-2)13(14-9-15)12(6-3)8-10/h7-8H,4-6H2,1-3H3


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