2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-fluoranyl-aniline

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-fluoranyl-aniline Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-fluoro-aniline CAS Name: 2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-4-fluoroaniline IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-fluoroaniline Traditional Name: [2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-4-fluoro-phenyl]amine Formula: C15H17FN4S MolecularWeight: 304.385683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=C(C=CC(=C4)F)N

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=C(C=CC(=C4)F)N

InChI

InChI=1S/C15H17FN4S/c16-11-3-6-13(17)10(7-11)8-21-15-19-18-14(9-1-2-9)20(15)12-4-5-12/h3,6-7,9,12H,1-2,4-5,8,17H2