3-(5-bromanylfuran-2-yl)-4-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(5-bromanylfuran-2-yl)-4-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-benzyl-5-(5-bromo-2-furyl)-1,2,4-triazole CAS Name: 3-(5-bromo-2-furanyl)-4-(phenylmethyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(5-bromofuran-2-yl)-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-benzyl-5-(5-bromo-2-furyl)-1,2,4-triazole Formula: C16H14BrN3OS MolecularWeight: 376.27086

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=C(O3)Br

Isomeric SMILES

C=CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=C(O3)Br

InChI

InChI=1S/C16H14BrN3OS/c1-2-10-22-16-19-18-15(13-8-9-14(17)21-13)20(16)11-12-6-4-3-5-7-12/h2-9H,1,10-11H2