4-[5-chloranyl-1-(1H-1,2,4-triazol-5-yl)pentyl]benzenecarbonitrile

Systemtic Name: 4-[5-chloranyl-1-(1H-1,2,4-triazol-5-yl)pentyl]benzenecarbonitrile Openeye Name: 4-[5-chloro-1-(1H-1,2,4-triazol-5-yl)pentyl]benzonitrile CAS Name: 4-[5-chloro-1-(1H-1,2,4-triazol-5-yl)pentyl]benzonitrile IUPAC Name: 4-[5-chloro-1-(1H-1,2,4-triazol-5-yl)pentyl]benzonitrile Traditional Name: 4-[5-chloro-1-(1H-1,2,4-triazol-5-yl)pentyl]benzonitrile Formula: C14H15ClN4 MolecularWeight: 274.7487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(CCCCCl)C2=NC=NN2

Isomeric SMILES

C1=CC(=CC=C1C#N)C(CCCCCl)C2=NC=NN2

InChI

InChI=1S/C14H15ClN4/c15-8-2-1-3-13(14-17-10-18-19-14)12-6-4-11(9-16)5-7-12/h4-7,10,13H,1-3,8H2,(H,17,18,19)