3-(2-chloranyl-1-benzothiophen-3-yl)-5-[(4-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(2-chloranyl-1-benzothiophen-3-yl)-5-[(4-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-chlorobenzothiophen-3-yl)-5-[(4-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-(2-chloro-1-benzothiophen-3-yl)-5-[(4-fluorophenyl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-chloro-1-benzothiophen-3-yl)-5-[(4-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-chlorobenzothiophen-3-yl)-5-[(4-fluorobenzyl)thio]-4-phenyl-1,2,4-triazole Formula: C23H15ClFN3S2 MolecularWeight: 451.966703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)C4=C(SC5=CC=CC=C54)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)C4=C(SC5=CC=CC=C54)Cl

InChI

InChI=1S/C23H15ClFN3S2/c24-21-20(18-8-4-5-9-19(18)30-21)22-26-27-23(28(22)17-6-2-1-3-7-17)29-14-15-10-12-16(25)13-11-15/h1-13H,14H2