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

Systemtic Name: 3-fluoranyl-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 3-fluoro-4-[[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-fluoro-4-[[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C15H11FN4S2 MolecularWeight: 330.403043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC2=NC(=NN2)SCC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1=CSC(=C1)CC2=NC(=NN2)SCC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C15H11FN4S2/c16-13-6-10(8-17)3-4-11(13)9-22-15-18-14(19-20-15)7-12-2-1-5-21-12/h1-6H,7,9H2,(H,18,19,20)