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

Systemtic Name: 4-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-fluoro-benzonitrile CAS Name: 4-[[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-fluorobenzonitrile Traditional Name: 4-[[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]-3-fluoro-benzonitrile Formula: C18H15FN4S2 MolecularWeight: 370.466903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=C(C=C(C=C3)C#N)F)CC4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=C(C=C(C=C3)C#N)F)CC4=CC=CS4

InChI

InChI=1S/C18H15FN4S2/c19-16-8-12(10-20)3-4-13(16)11-25-18-22-21-17(23(18)14-5-6-14)9-15-2-1-7-24-15/h1-4,7-8,14H,5-6,9,11H2