3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-5-propan-2-yl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chloro-4-fluoro-benzyl)thio]-5-isopropyl-1,2,4-triazole Formula: C15H17ClFN3S MolecularWeight: 325.831983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC=C)SCC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)C1=NN=C(N1CC=C)SCC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C15H17ClFN3S/c1-4-7-20-14(10(2)3)18-19-15(20)21-9-11-5-6-12(17)8-13(11)16/h4-6,8,10H,1,7,9H2,2-3H3