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

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-(5-methyl-4-phenyl-thiophen-3-yl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-5-(5-methyl-4-phenyl-3-thienyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-5-(5-methyl-4-phenyl-3-thiophenyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-5-(5-methyl-4-phenylthiophen-3-yl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chloro-4-fluoro-benzyl)thio]-5-(5-methyl-4-phenyl-3-thienyl)-1,2,4-triazole Formula: C23H19ClFN3S2 MolecularWeight: 455.998463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CS1)C2=NN=C(N2CC=C)SCC3=C(C=C(C=C3)F)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CS1)C2=NN=C(N2CC=C)SCC3=C(C=C(C=C3)F)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H19ClFN3S2/c1-3-11-28-22(19-14-29-15(2)21(19)16-7-5-4-6-8-16)26-27-23(28)30-13-17-9-10-18(25)12-20(17)24/h3-10,12,14H,1,11,13H2,2H3