4-ethyl-3-[(4-fluorophenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(4-fluorophenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole Openeye Name: 4-ethyl-3-[(4-fluorophenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole CAS Name: 4-ethyl-3-[(4-fluorophenyl)methylthio]-5-(2-pyrrolidinyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(4-fluorophenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole Traditional Name: 4-ethyl-3-[(4-fluorobenzyl)thio]-5-pyrrolidin-2-yl-1,2,4-triazole Formula: C15H19FN4S MolecularWeight: 306.401563

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3CCCN3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3CCCN3

InChI

InChI=1S/C15H19FN4S/c1-2-20-14(13-4-3-9-17-13)18-19-15(20)21-10-11-5-7-12(16)8-6-11/h5-8,13,17H,2-4,9-10H2,1H3