3-(2-fluorophenyl)-5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(2-fluorophenyl)-5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-benzylsulfanyl-5-(2-fluorophenyl)-1,2,4-triazole CAS Name: 3-(2-fluorophenyl)-5-(phenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(benzylthio)-5-(2-fluorophenyl)-1,2,4-triazole Formula: C18H16FN3S MolecularWeight: 325.403143

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3F

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3F

InChI

InChI=1S/C18H16FN3S/c1-2-12-22-17(15-10-6-7-11-16(15)19)20-21-18(22)23-13-14-8-4-3-5-9-14/h2-11H,1,12-13H2