4-(3-methoxypropyl)-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole

Systemtic Name: 4-(3-methoxypropyl)-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole Openeye Name: 4-(3-methoxypropyl)-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole CAS Name: 4-(3-methoxypropyl)-3-(methylthio)-5-(phenoxymethyl)-1,2,4-triazole IUPAC Name: 4-(3-methoxypropyl)-3-methylsulfanyl-5-(phenoxymethyl)-1,2,4-triazole Traditional Name: 4-(3-methoxypropyl)-3-(methylthio)-5-(phenoxymethyl)-1,2,4-triazole Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SC)COC2=CC=CC=C2

Isomeric SMILES

COCCCN1C(=NN=C1SC)COC2=CC=CC=C2

InChI

InChI=1S/C14H19N3O2S/c1-18-10-6-9-17-13(15-16-14(17)20-2)11-19-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3