3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl]-4-(4-isopropylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-4-p-cumenyl-1H-1,2,4-triazole-5-thione Formula: C18H17ClFN3S MolecularWeight: 361.864083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NNC2=S)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NNC2=S)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H17ClFN3S/c1-11(2)12-6-8-13(9-7-12)23-17(21-22-18(23)24)10-14-15(19)4-3-5-16(14)20/h3-9,11H,10H2,1-2H3,(H,22,24)