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

Systemtic Name: 3-fluoranyl-4-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 3-fluoro-4-[[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-fluoro-4-[[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C16H13FN4S2 MolecularWeight: 344.429623

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=C(C=C2)C#N)F)CC3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=C(C=C2)C#N)F)CC3=CC=CS3

InChI

InChI=1S/C16H13FN4S2/c1-21-15(8-13-3-2-6-22-13)19-20-16(21)23-10-12-5-4-11(9-18)7-14(12)17/h2-7H,8,10H2,1H3