3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-5-(3-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-5-(3-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-1,2,4-triazole CAS Name: 3-[(2,6-difluorophenyl)methylthio]-5-(3-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2,6-difluorobenzyl)thio]-5-(3-methoxyphenyl)-1,2,4-triazole Formula: C19H17F2N3OS MolecularWeight: 373.419586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=C(C=CC=C3F)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=C(C=CC=C3F)F

InChI

InChI=1S/C19H17F2N3OS/c1-3-10-24-18(13-6-4-7-14(11-13)25-2)22-23-19(24)26-12-15-16(20)8-5-9-17(15)21/h3-9,11H,1,10,12H2,2H3