5-(4-butyl-2-chloranyl-phenyl)-3-(2-chloranyl-6-fluoranyl-phenyl)-1-methyl-1,2,4-triazole

Systemtic Name: 5-(4-butyl-2-chloranyl-phenyl)-3-(2-chloranyl-6-fluoranyl-phenyl)-1-methyl-1,2,4-triazole Openeye Name: 5-(4-butyl-2-chloro-phenyl)-3-(2-chloro-6-fluoro-phenyl)-1-methyl-1,2,4-triazole CAS Name: 5-(4-butyl-2-chlorophenyl)-3-(2-chloro-6-fluorophenyl)-1-methyl-1,2,4-triazole IUPAC Name: 5-(4-butyl-2-chlorophenyl)-3-(2-chloro-6-fluorophenyl)-1-methyl-1,2,4-triazole Traditional Name: 5-(4-butyl-2-chloro-phenyl)-3-(2-chloro-6-fluoro-phenyl)-1-methyl-1,2,4-triazole Formula: C19H18Cl2FN3 MolecularWeight: 378.270723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C2=NC(=NN2C)C3=C(C=CC=C3Cl)F)Cl

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C2=NC(=NN2C)C3=C(C=CC=C3Cl)F)Cl

InChI

InChI=1S/C19H18Cl2FN3/c1-3-4-6-12-9-10-13(15(21)11-12)19-23-18(24-25(19)2)17-14(20)7-5-8-16(17)22/h5,7-11H,3-4,6H2,1-2H3