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2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name:2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile
Openeye Name:2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
CAS Name:2-[[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile
IUPAC Name:2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
Traditional Name:2-[[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile
Formula: C16H18N4S
MolecularWeight: 298.40592
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC2=NC(=NN2)SCC3=CC=CC=C3C#N


Isomeric SMILES

C1CCC(C1)CC2=NC(=NN2)SCC3=CC=CC=C3C#N


InChI

InChI=1S/C16H18N4S/c17-10-13-7-3-4-8-14(13)11-21-16-18-15(19-20-16)9-12-5-1-2-6-12/h3-4,7-8,12H,1-2,5-6,9,11H2,(H,18,19,20)


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