2-chloranyl-3-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 2-chloranyl-3-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-3-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C21H16ClFN4S MolecularWeight: 410.894943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)C5=CC=CC=C5F

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)C5=CC=CC=C5F

InChI

InChI=1S/C21H16ClFN4S/c22-19-14(11-13-5-1-4-8-18(13)24-19)12-28-21-26-25-20(27(21)15-9-10-15)16-6-2-3-7-17(16)23/h1-8,11,15H,9-10,12H2