4-ethyl-3-(phenoxymethyl)-5-prop-2-ynylsulfanyl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(phenoxymethyl)-5-prop-2-ynylsulfanyl-1,2,4-triazole Openeye Name: 4-ethyl-3-(phenoxymethyl)-5-prop-2-ynylsulfanyl-1,2,4-triazole CAS Name: 4-ethyl-3-(phenoxymethyl)-5-(prop-2-ynylthio)-1,2,4-triazole IUPAC Name: 4-ethyl-3-(phenoxymethyl)-5-prop-2-ynylsulfanyl-1,2,4-triazole Traditional Name: 4-ethyl-3-(phenoxymethyl)-5-(propargylthio)-1,2,4-triazole Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC#C)COC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCC#C)COC2=CC=CC=C2

InChI

InChI=1S/C14H15N3OS/c1-3-10-19-14-16-15-13(17(14)4-2)11-18-12-8-6-5-7-9-12/h1,5-9H,4,10-11H2,2H3