3-(furan-2-yl)-5-(2-phenoxyethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-5-(2-phenoxyethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(2-furyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-furanyl)-5-(2-phenoxyethylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(furan-2-yl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-(2-furyl)-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCCOC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C21H19N3O2S/c1-3-8-17(9-4-1)16-24-20(19-12-7-13-26-19)22-23-21(24)27-15-14-25-18-10-5-2-6-11-18/h1-13H,14-16H2