5-dec-9-enyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-dec-9-enyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-dec-9-enyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-dec-9-enyl-3-(2-phenoxyethylthio)-1H-1,2,4-triazole IUPAC Name: 5-dec-9-enyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-dec-9-enyl-3-(2-phenoxyethylthio)-1H-1,2,4-triazole Formula: C20H29N3OS MolecularWeight: 359.52876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC1=NC(=NN1)SCCOC2=CC=CC=C2

Isomeric SMILES

C=CCCCCCCCCC1=NC(=NN1)SCCOC2=CC=CC=C2

InChI

InChI=1S/C20H29N3OS/c1-2-3-4-5-6-7-8-12-15-19-21-20(23-22-19)25-17-16-24-18-13-10-9-11-14-18/h2,9-11,13-14H,1,3-8,12,15-17H2,(H,21,22,23)