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4-[phenyl(1H-pyrazol-5-ylsulfanyl)methoxy]butanenitrile

4-[phenyl(1H-pyrazol-5-ylsulfanyl)methoxy]butanenitrile

Systemtic Name:4-[phenyl(1H-pyrazol-5-ylsulfanyl)methoxy]butanenitrile
Openeye Name:4-[phenyl(1H-pyrazol-5-ylsulfanyl)methoxy]butanenitrile
CAS Name:4-[phenyl-(1H-pyrazol-5-ylthio)methoxy]butanenitrile
IUPAC Name:4-[phenyl(1H-pyrazol-5-ylsulfanyl)methoxy]butanenitrile
Traditional Name:4-[phenyl-(1H-pyrazol-5-ylthio)methoxy]butyronitrile
Formula: C14H15N3OS
MolecularWeight: 273.3534
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(OCCCC#N)SC2=CC=NN2


Isomeric SMILES

C1=CC=C(C=C1)C(OCCCC#N)SC2=CC=NN2


InChI

InChI=1S/C14H15N3OS/c15-9-4-5-11-18-14(12-6-2-1-3-7-12)19-13-8-10-16-17-13/h1-3,6-8,10,14H,4-5,11H2,(H,16,17)


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