3-(furan-2-yl)-4-(4-phenylmethoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-4-(4-phenylmethoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-(4-benzyloxyphenyl)-5-(2-furyl)-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-(4-phenylmethoxyphenyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-(4-phenylmethoxyphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-(4-benzoxyphenyl)-5-(2-furyl)-1,2,4-triazole Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C=CCSC1=NN=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C22H19N3O2S/c1-2-15-28-22-24-23-21(20-9-6-14-26-20)25(22)18-10-12-19(13-11-18)27-16-17-7-4-3-5-8-17/h2-14H,1,15-16H2